A0A067Y2M2_ORYSJ Loading...

ATP synthase subunit beta

Mitochondrial membrane ATP synthase (F(1)F(0) ATP synthase or Complex V) produces ATP from ADP in the presence of a proton gradient across the membrane which is generated by electron transport complexes of the respiratory chain. F-type ATPases consist of two structural domains, F(1) - containing the extramembraneous catalytic core, and F(0) - containing the membrane proton channel, linked together by a central stalk and a peripheral stalk. During catalysis, ATP synthesis in the catalytic domain of F(1) is coupled via a rotary mechanism of the central stalk subunits to proton translocation. Subunits alpha and beta form the catalytic core in F(1). Rotation of the central stalk against the surrounding alpha(3)beta(3) subunits leads to hydrolysis of ATP in three separate catalytic sites on the beta subunits. Produces ATP from ADP in the presence of a proton gradient across the membrane.

AlphaFold DB (Q01859), UniProt , Accession A0A067Y2M2, Species ORYSJ (Oryza sativa subsp. japonica, Rice), Gene n/a, Length 552 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.7	Very low	34.6	Very low	255 Å²	255	160.3 Å²	160.3	100%	1.256	87%	0.872	S	S	*	*				0	119.2	0	-68	177.6	173	0	0	106.3
2	A	37.1	Very low	33.9	Very low	91 Å²	91	168.3 Å²	168.3	75%	0.752	88%	0.88	S	S	*	*			cis	-131.2	144.3	-2.8	0	0	0	0	0	105.2
3	T	37.9	Very low	33.5	Very low	140 Å²	140	161.8 Å²	161.8	86%	0.859	87%	0.865	S	S	*	*				-167.8	101.7	77.9	34.6	0	0	0	0	107.8
4	R	34.7	Very low	33.4	Very low	246 Å²	246	158 Å²	158	93%	0.928	87%	0.868	S	S	*	*			trans	-127	132.3	167.1	-87.5	-176.3	173.7	-177.4	-1.8	106.3
5	R	35	Very low	32.8	Very low	251 Å²	251	154.3 Å²	154.3	95%	0.947	86%	0.858	S	S	*	*			trans	95.6	82.9	174.2	-58.3	179.6	171.2	-175.3	-2.5	116.6
6	A	34.4	Very low	32.4	Very low	91 Å²	91	159.4 Å²	159.4	75%	0.752	86%	0.86	S	S	*	*			trans	-171.1	101.2	138.1	0	0	0	0	0	107.7
7	L	36.9	Very low	32.3	Very low	180 Å²	180	159.8 Å²	159.8	94%	0.942	86%	0.86	S	S	*	*			trans	168.1	64.4	154	-90	150.5	0	0	0	108.7
8	S	31.4	Very low	31.8	Very low	124 Å²	124	164.8 Å²	164.8	87%	0.867	87%	0.865	S	S	*	*	S	Bend	trans	-139.2	38.8	168.8	56.5	0	0	0	0	111.1
9	S	31.5	Very low	31.6	Very low	102 Å²	102	160.6 Å²	160.6	71%	0.713	87%	0.866	S	S	*	*			trans	-156.1	92.2	176.5	58.5	0	0	0	0	110.7
10	L	31.7	Very low	31.2	Very low	166 Å²	166	157.7 Å²	157.7	87%	0.869	86%	0.864	S	S	*	*			trans	163.5	104.8	163.4	-89.6	153.8	0	0	0	102.7
11	V	34.3	Very low	31.1	Very low	117 Å²	117	156 Å²	156	71%	0.709	86%	0.864	S	S	*	*			cis	-158.4	98.7	43.8	173.5	0	0	0	0	107.6	A13	V11-A13 HydrophobicContact CG1-CB 4.3Å
12	R	26.1	Very low	31.3	Very low	257 Å²	257	149.4 Å²	149.4	97%	0.97	84%	0.84	S	S	*	*			trans	-85.2	94	147	-102.3	-177.9	173.7	-178.4	-1	105.8
13	A	29	Very low	30.7	Very low	83 Å²	83	149.7 Å²	149.7	69%	0.686	84%	0.842	S	S	*	*			trans	-170.6	84.4	163.6	0	0	0	0	0	111	V11	V11-A13 HydrophobicContact CG1-CB 4.3Å
14	A	32.6	Very low	30.5	Very low	109 Å²	109	149.1 Å²	149.1	90%	0.901	84%	0.841	S	S	*	*			trans	-165	65.4	149.7	0	0	0	0	0	108.9
15	S	24.3	Very low	30.1	Very low	103 Å²	103	148.9 Å²	148.9	72%	0.72	84%	0.84	S	S	*	*			trans	-105.4	129.9	154.9	59.3	0	0	0	0	106.6
16	R	25.2	Very low	30.5	Very low	235 Å²	235	142 Å²	142	89%	0.887	83%	0.828	S	S	*	*			trans	125.1	119.2	161.5	-70.1	169.1	-178.2	-158.5	-0.3	113.7
17	L	31	Very low	30.1	Very low	166 Å²	166	149.3 Å²	149.3	87%	0.869	84%	0.836	S	S	*	*			trans	144.6	89.8	140.6	-76.5	160.2	0	0	0	107.5
18	R	22.8	Very low	29.9	Very low	251 Å²	251	144.1 Å²	144.1	95%	0.947	83%	0.827	S	S	*	*				40.1	105	86.1	-81.9	-168.9	175.9	-156.5	-0.3	113.1
19	G	28.9	Very low	29.8	Very low	85 Å²	85	144 Å²	144	88%	0.876	82%	0.823	S	S	*	*			trans	-164.2	99.3	165	0	0	0	0	0	110
20	A	24.5	Very low	29.7	Very low	101 Å²	101	146.8 Å²	146.8	84%	0.835	83%	0.829	S	S	*	*			trans	-98.9	130	167.4	0	0	0	0	0	108.3
21	S	28.4	Very low	29.8	Very low	122 Å²	122	148.1 Å²	148.1	85%	0.853	83%	0.83	S	S	*	*			trans	-178.7	161.4	158.1	-117.4	0	0	0	0	111.4
22	P	40.4	Very low	29.7	Very low	118 Å²	118	153.3 Å²	153.3	77%	0.766	84%	0.837	S	S	*	*				-115.2	175.8	-124.1	25.4	-3.7	0	0	0	114.5
23	A	24.5	Very low	30.3	Very low	96 Å²	96	145.7 Å²	145.7	79%	0.793	82%	0.821	S	S	*	*			trans	-49	145	178.3	0	0	0	0	0	115.6
24	P	32.5	Very low	31.1	Very low	128 Å²	128	145 Å²	145	83%	0.831	81%	0.811	S	S	*	*			trans	-95.6	131.5	159.9	31.1	-22.5	0	0	0	112.5
25	R	27.2	Very low	31.8	Very low	241 Å²	241	145.1 Å²	145.1	91%	0.909	80%	0.802	S	S	*	*			trans	-121.6	165.9	148.7	-82.4	-176.5	171.6	-172.1	-1.7	105.6
26	P	42.5	Very low	32.8	Very low	107 Å²	107	143.5 Å²	143.5	70%	0.695	79%	0.791	S	S	*	*			cis	-131.7	-170.9	-20.3	29.6	-6.9	0	0	0	112.4
27	R	27.4	Very low	33.7	Very low	244 Å²	244	133.9 Å²	133.9	92%	0.921	77%	0.765	S	S	*	*			trans	115.2	124.3	148.2	-65.4	-178.7	171.4	178.3	-2.1	116.8
28	G	31	Very low	34.6	Very low	72 Å²	72	134.4 Å²	134.4	74%	0.742	76%	0.757	S	S	*	*			trans	139.6	118.8	153.2	0	0	0	0	0	114.4
29	P	29.6	Very low	35.7	Very low	120 Å²	120	128.6 Å²	128.6	78%	0.779	74%	0.744	S	S	*	*			trans	-88.7	152.9	175.4	35.8	-30.8	0	0	0	112.2
30	L	30.2	Very low	36.7	Very low	162 Å²	162	132.1 Å²	132.1	85%	0.848	74%	0.735	S	S	*	*			trans	66.5	89.2	157.1	-60.5	164.3	0	0	0	117.9
31	H	33	Very low	37.8	Very low	193 Å²	193	133.5 Å²	133.5	89%	0.894	73%	0.729	S	S	*	*			trans	-121.7	109.4	143.5	-133.5	28	0	0	0	109.4
32	R	33.3	Very low	38.8	Very low	226 Å²	226	136.2 Å²	136.2	85%	0.853	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-60.5	127.3	168.5	-74.6	177.2	170.8	178.8	-3.9	107.3	S34	R32-S34 PolarHBondContact O-N 2.79Å
33	P	39.1	Very low	39.3	Very low	98 Å²	98	133.2 Å²	133.2	64%	0.636	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-66.9	121.5	178.6	26.2	-30.2	0	0	0	108.6	Y38	P33-Y38 HydrophobicContact CG-CE2 4.5Å
34	S	44.2	Very low	40.4	Very low	69 Å²	69	131 Å²	131	48%	0.483	69%	0.687	S	S	.	*	P	Polyproline II helix	trans	-65	151.7	169.1	60.9	0	0	0	0	109.6	R32 S36 G37	R32-S34 PolarHBondContact O-N 2.79Å; S34-S36 PolarHBondContact O-N 3.03Å; S34-S36 PolarHBondContact OG-OG 3.33Å; S34-G37 PolarHBondContact O-N 2.81Å
35	P	47.3	Very low	41.1	Very low	110 Å²	110	127.7 Å²	127.7	71%	0.714	67%	0.671	S	S	*	*	H	α-helix	trans	-56	-27.2	-175.1	-23.5	32.5	0	0	0	113.7	G37 Y38	P35-G37 VanDerWaalsContact C-N 3.34Å; P35-G37 PolarHBondContact O-N 2.88Å; P35-Y38 PolarHBondContact O-N 3.2Å
36	S	45.5	Very low	41.9	Very low	69 Å²	69	124.3 Å²	124.3	48%	0.483	66%	0.659	S	S	.	*	H	α-helix	trans	-67.1	-30.6	178.6	26.6	0	0	0	0	113.1	S34 Y38 L39 F40	S34-S36 PolarHBondContact O-N 3.03Å; S34-S36 PolarHBondContact OG-OG 3.33Å; S36-Y38 VanDerWaalsContact C-N 3.31Å; S36-Y38 PolarHBondContact O-N 3.37Å; S36-L39 PolarHBondContact O-N 3.24Å; S36-F40 VanDerWaalsContact O-CD2 3.3Å; S36-F40 WeakPolarHBondContact O-CD2 3.42Å; S36-F40 PolarHBondContact O-N 3.11Å
37	G	44.3	Very low	41.9	Very low	33 Å²	33	122.5 Å²	122.5	34%	0.34	65%	0.653	S	S	.	*	H	α-helix	trans	-69.1	-28.1	175.8	0	0	0	0	0	113.7	S34 P35 N41	S34-G37 PolarHBondContact O-N 2.81Å; P35-G37 VanDerWaalsContact C-N 3.34Å; P35-G37 PolarHBondContact O-N 2.88Å; G37-N41 PolarHBondContact O-N 3.1Å
38	Y	49.5	Very low	42.6	Very low	177 Å²	177	115.8 Å²	115.8	69%	0.694	64%	0.639	S	S	*	*	H	α-helix	trans	-69.8	-33.3	179.3	-114.7	-91.8	0	0	0	112.5	P33 P35 S36	P33-Y38 HydrophobicContact CG-CE2 4.5Å; P35-Y38 PolarHBondContact O-N 3.2Å; S36-Y38 VanDerWaalsContact C-N 3.31Å; S36-Y38 PolarHBondContact O-N 3.37Å
39	L	46.5	Very low	43	Very low	130 Å²	130	115.6 Å²	115.6	68%	0.681	63%	0.631	S	S	*	*	H	α-helix	trans	-77.7	-39.1	179	-76	163.3	0	0	0	112.3	S36 R42 A43	S36-L39 PolarHBondContact O-N 3.24Å; L39-R42 PolarHBondContact O-N 2.99Å; L39-A43 PolarHBondContact O-N 2.69Å
40	F	50.3	Low	43.4	Very low	158 Å²	158	114.1 Å²	114.1	69%	0.693	63%	0.629	S	S	*	*	H	α-helix	trans	-69.8	-36.6	-179	-82.8	-73	0	0	0	113.4	S36 R42 A43 A44	S36-F40 VanDerWaalsContact O-CD2 3.3Å; S36-F40 WeakPolarHBondContact O-CD2 3.42Å; S36-F40 PolarHBondContact O-N 3.11Å; F40-R42 VanDerWaalsContact C-N 3.33Å; F40-R42 PolarHBondContact O-N 3.39Å; F40-A43 PolarHBondContact O-N 3.15Å; F40-A44 WeakPolarHBondContact O-CB 3.48Å; F40-A44 PolarHBondContact O-N 3.27Å
41	N	47.9	Very low	43.6	Very low	131 Å²	131	110.5 Å²	110.5	70%	0.701	62%	0.622	S	S	*	*	H	α-helix	trans	-67.8	-32.7	176.1	-85	-11.6	0	0	0	112.5	G37 A45	G37-N41 PolarHBondContact O-N 3.1Å; N41-A45 WeakPolarHBondContact O-CB 3.4Å; N41-A45 PolarHBondContact O-N 3.29Å
42	R	48.7	Very low	43.8	Very low	178 Å²	178	105 Å²	105	67%	0.672	61%	0.611	S	S	*	*	H	α-helix	trans	-73	-44.2	173	-107.2	-173.5	165	178	-4	111.7	L39 F40 A44 A45 Y46	L39-R42 PolarHBondContact O-N 2.99Å; F40-R42 VanDerWaalsContact C-N 3.33Å; F40-R42 PolarHBondContact O-N 3.39Å; R42-A44 VanDerWaalsContact C-N 3.28Å; R42-A44 PolarHBondContact O-N 2.8Å; R42-A45 PolarHBondContact O-N 3.28Å; R42-A45 VanDerWaalsContact O-N 3.17Å; R42-Y46 WeakPolarHBondContact O-CB 3.35Å; R42-Y46 VanDerWaalsContact O-CD2 3.28Å; R42-Y46 WeakPolarHBondContact O-CD2 3.33Å; R42-Y46 PolarHBondContact O-N 3.06Å
43	A	50	Low	43.8	Very low	56 Å²	56	103.8 Å²	103.8	46%	0.463	61%	0.611	S	S	.	*	H	α-helix	trans	-60.5	-38.8	176.9	0	0	0	0	0	112	L39 F40 Y46 A47	L39-A43 PolarHBondContact O-N 2.69Å; F40-A43 PolarHBondContact O-N 3.15Å; A43-Y46 PolarHBondContact O-N 3.4Å; A43-A47 WeakPolarHBondContact O-CB 3.42Å; A43-A47 PolarHBondContact O-N 2.68Å
44	A	47.6	Very low	43.5	Very low	49 Å²	49	108.3 Å²	108.3	41%	0.405	62%	0.624	S	S	.	*	H	α-helix	trans	-68.9	-38.9	174.9	0	0	0	0	0	112.6	F40 R42 Y46 A47 T48	F40-A44 WeakPolarHBondContact O-CB 3.48Å; F40-A44 PolarHBondContact O-N 3.27Å; R42-A44 VanDerWaalsContact C-N 3.28Å; R42-A44 PolarHBondContact O-N 2.8Å; A44-Y46 VanDerWaalsContact C-N 3.33Å; A44-A47 PolarHBondContact O-N 2.97Å; A44-T48 WeakPolarHBondContact O-CB 3.48Å; A44-T48 PolarHBondContact O-N 3.49Å; A44-T48 PolarHBondContact O-OG1 3.4Å
45	A	48.7	Very low	43	Very low	58 Å²	58	109.5 Å²	109.5	48%	0.479	64%	0.638	S	S	.	*	H	α-helix	trans	-65.2	-36.4	173.2	0	0	0	0	0	112.2	N41 R42 A49	N41-A45 WeakPolarHBondContact O-CB 3.4Å; N41-A45 PolarHBondContact O-N 3.29Å; R42-A45 PolarHBondContact O-N 3.28Å; R42-A45 VanDerWaalsContact O-N 3.17Å; A45-A49 WeakPolarHBondContact O-CB 3.43Å; A45-A49 PolarHBondContact O-N 3.39Å
46	Y	44.2	Very low	42.4	Very low	171 Å²	171	108.2 Å²	108.2	67%	0.671	64%	0.637	S	S	*	*	H	α-helix	trans	-71.6	-37.5	173.5	-90.4	-83.9	0	0	0	112.6	R42 A43 A44	R42-Y46 WeakPolarHBondContact O-CB 3.35Å; R42-Y46 VanDerWaalsContact O-CD2 3.28Å; R42-Y46 WeakPolarHBondContact O-CD2 3.33Å; R42-Y46 PolarHBondContact O-N 3.06Å; A43-Y46 PolarHBondContact O-N 3.4Å; A44-Y46 VanDerWaalsContact C-N 3.33Å
47	A	42.1	Very low	42	Very low	69 Å²	69	110.4 Å²	110.4	57%	0.57	65%	0.649	S	S	*	*	H	α-helix	trans	-78.5	-30.4	-177.9	0	0	0	0	0	113.4	A43 A44	A43-A47 WeakPolarHBondContact O-CB 3.42Å; A43-A47 PolarHBondContact O-N 2.68Å; A44-A47 PolarHBondContact O-N 2.97Å
48	T	40.7	Very low	41.5	Very low	102 Å²	102	114.6 Å²	114.6	63%	0.626	67%	0.671	S	S	*	*	H	α-helix	trans	-86.9	-22.6	179.1	49.4	0	0	0	0	113.4	A44 A50 A51	A44-T48 WeakPolarHBondContact O-CB 3.48Å; A44-T48 PolarHBondContact O-N 3.49Å; A44-T48 PolarHBondContact O-OG1 3.4Å; T48-A50 PolarHBondContact O-N 3.38Å; T48-A51 PolarHBondContact O-N 3.25Å
49	A	39.8	Very low	40.8	Very low	68 Å²	68	110.4 Å²	110.4	56%	0.562	67%	0.673	S	S	*	*	H	α-helix	trans	-65.5	-27.8	170.5	0	0	0	0	0	112.5	A45 A51 A52	A45-A49 WeakPolarHBondContact O-CB 3.43Å; A45-A49 PolarHBondContact O-N 3.39Å; A49-A51 PolarHBondContact O-N 2.64Å; A49-A52 PolarHBondContact O-N 2.97Å
50	A	37.8	Very low	40	Very low	90 Å²	90	109.4 Å²	109.4	74%	0.744	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-12	176	0	0	0	0	0	114	T48	T48-A50 PolarHBondContact O-N 3.38Å
51	A	35	Very low	39.1	Very low	86 Å²	86	106.1 Å²	106.1	71%	0.711	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	7.9	177.9	0	0	0	0	0	113.6	T48 A49 K53	T48-A51 PolarHBondContact O-N 3.25Å; A49-A51 PolarHBondContact O-N 2.64Å; A51-K53 PolarHBondContact O-N 2.87Å
52	A	36.8	Very low	38.2	Very low	78 Å²	78	106.6 Å²	106.6	65%	0.645	68%	0.683	S	S	*	*	S	Bend	trans	-71	111.4	170.7	0	0	0	0	0	108.7	A49 E54	A49-A52 PolarHBondContact O-N 2.97Å; A52-E54 PolarHBondContact O-N 3.14Å
53	K	34.8	Very low	37.4	Very low	199 Å²	199	101.2 Å²	101.2	87%	0.865	68%	0.683	S	S	*	*			trans	-40.1	128.5	166.6	-87.1	177.6	170.2	178.6	0	109.2	A51 A55	A51-K53 PolarHBondContact O-N 2.87Å; K53-A55 PolarHBondContact O-N 2.95Å
54	E	32.7	Very low	36.4	Very low	194 Å²	194	107 Å²	107	91%	0.907	70%	0.698	S	S	*	*			trans	-30.2	103.1	168.2	-97	171.6	148.9	0	0	110.1	A52 A56	A52-E54 PolarHBondContact O-N 3.14Å; E54-A56 PolarHBondContact O-N 3.36Å
55	A	33.6	Very low	35.6	Very low	93 Å²	93	109.8 Å²	109.8	77%	0.769	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-64.9	123.4	162.9	0	0	0	0	0	105.2	K53	K53-A55 PolarHBondContact O-N 2.95Å
56	A	35.1	Very low	34.8	Very low	84 Å²	84	112 Å²	112	69%	0.694	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-48.9	140.8	172.3	0	0	0	0	0	109	E54	E54-A56 PolarHBondContact O-N 3.36Å
57	P	36.9	Very low	34.2	Very low	114 Å²	114	105.9 Å²	105.9	74%	0.74	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-51.6	141.5	-178.6	20.8	-31.4	0	0	0	109.3	A59	P57-A59 PolarHBondContact O-N 3.16Å; P57-A59 VanDerWaalsContact O-N 3.15Å
58	P	33.3	Very low	33.6	Very low	122 Å²	122	105.6 Å²	105.6	79%	0.792	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-53.2	129.6	178.8	22.7	-31	0	0	0	108.1
59	A	33.4	Very low	33.2	Very low	89 Å²	89	102.1 Å²	102.1	74%	0.736	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-54.9	132.3	172.1	0	0	0	0	0	107.5	P57 A61	P57-A59 PolarHBondContact O-N 3.16Å; P57-A59 VanDerWaalsContact O-N 3.15Å; A59-A61 PolarHBondContact O-N 3.43Å
60	P	31.1	Very low	33.3	Very low	108 Å²	108	107.8 Å²	107.8	70%	0.701	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-53.3	134.1	-179	20.2	-30.3	0	0	0	108.4	T62	P60-T62 PolarHBondContact O-N 2.91Å
61	A	31.9	Very low	33.3	Very low	90 Å²	90	109 Å²	109	74%	0.744	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-48.1	120	176.8	0	0	0	0	0	107.7	A59 G63	A59-A61 PolarHBondContact O-N 3.43Å; A61-G63 PolarHBondContact O-N 3.16Å
62	T	28.8	Very low	33.8	Very low	140 Å²	140	107.7 Å²	107.7	86%	0.859	69%	0.694	S	S	*	*			trans	-72.1	72	170.5	43.2	0	0	0	0	107	P60 K64	P60-T62 PolarHBondContact O-N 2.91Å; T62-K64 PolarHBondContact O-N 3.28Å
63	G	30.5	Very low	34	Very low	65 Å²	65	110.8 Å²	110.8	67%	0.67	70%	0.699	S	S	*	*			trans	-55.5	110	164.3	0	0	0	0	0	106.1	A61 A65	A61-G63 PolarHBondContact O-N 3.16Å; G63-A65 PolarHBondContact O-N 3.05Å
64	K	28.9	Very low	34.7	Very low	179 Å²	179	109.7 Å²	109.7	78%	0.778	70%	0.697	S	S	*	*			trans	-52.1	119.1	165.5	-77.9	177.4	174.7	176	0	105.7	T62 T66	T62-K64 PolarHBondContact O-N 3.28Å; K64-T66 HydrophobicContact CB-CG2 4.09Å; K64-T66 PolarHBondContact O-N 3.38Å; K64-T66 PolarHBondContact O-OG1 2.84Å
65	A	31.2	Very low	35.6	Very low	106 Å²	106	103.9 Å²	103.9	88%	0.876	67%	0.669	S	S	*	*			trans	-52.6	92.3	170.6	0	0	0	0	0	108.6	G63	G63-A65 PolarHBondContact O-N 3.05Å
66	T	31.7	Very low	36.5	Very low	105 Å²	105	102.7 Å²	102.7	64%	0.644	65%	0.652	S	S	*	*			trans	-127.4	58.3	-178.5	42.1	0	0	0	0	106.5	K64	K64-T66 HydrophobicContact CB-CG2 4.09Å; K64-T66 PolarHBondContact O-N 3.38Å; K64-T66 PolarHBondContact O-OG1 2.84Å
67	G	31.5	Very low	37.6	Very low	43 Å²	43	101 Å²	101	44%	0.443	64%	0.644	S	S	.	*			trans	171.7	43.7	-175.3	0	0	0	0	0	111.9	G69	G67-G69 PolarHBondContact O-N 3.44Å
68	G	29.9	Very low	38.6	Very low	63 Å²	63	100.6 Å²	100.6	65%	0.649	65%	0.65	S	S	*	*			trans	-56.6	128.6	162.6	0	0	0	0	0	107.5	K70	G68-K70 PolarHBondContact O-N 3.44Å
69	G	33.9	Very low	40.4	Very low	28 Å²	28	95.3 Å²	95.3	29%	0.289	62%	0.618	S	S	.	*			trans	-45.7	133.4	179.4	0	0	0	0	0	110.3	G67 I71	G67-G69 PolarHBondContact O-N 3.44Å; G69-I71 PolarHBondContact O-N 3.39Å
70	K	40.6	Very low	42.8	Very low	188 Å²	188	91.6 Å²	91.6	82%	0.817	59%	0.586	S	S	*	*			trans	-60	104.9	172.8	-77.3	-178.5	179.2	175	0	107	G68 T72	G68-K70 PolarHBondContact O-N 3.44Å; K70-T72 PolarHBondContact O-N 2.97Å; K70-T72 VanDerWaalsContact O-N 3.1Å
71	I	38.3	Very low	45.6	Very low	114 Å²	114	88.2 Å²	88.2	59%	0.585	56%	0.564	S	S	*	*			trans	-57.3	112	174.6	-64.1	176	0	0	0	107	G69 T76	G69-I71 PolarHBondContact O-N 3.39Å; I71-T76 HydrophobicContact CG2-CG2 3.16Å
72	T	45	Very low	48.6	Very low	60 Å²	60	84 Å²	84	37%	0.368	53%	0.529	S	S	.	.			trans	-84.4	125.9	174.6	53.4	0	0	0	0	109.5	K70 E74 F75 T76 T149	K70-T72 PolarHBondContact O-N 2.97Å; K70-T72 VanDerWaalsContact O-N 3.1Å; T72-E74 PolarHBondContact O-N 2.76Å; T72-F75 PolarHBondContact O-N 3.38Å; T72-T76 WeakPolarHBondContact O-CG2 3.39Å; T72-T149 PolarHBondContact OG1-O 2.96Å
73	D	41.7	Very low	51.7	Low	142 Å²	142	80.9 Å²	80.9	76%	0.759	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-54.1	-22	-169.2	-73.9	-35.2	0	0	0	115.7	F75 T76	D73-F75 VanDerWaalsContact C-N 3.27Å; D73-F75 PolarHBondContact O-N 3.49Å; D73-T76 PolarHBondContact O-OG1 2.97Å
74	E	49.3	Very low	54.9	Low	176 Å²	176	77.9 Å²	77.9	82%	0.822	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-71.5	-14.9	-176.8	-67.4	-173.9	167.4	0	0	114.5	T72	T72-E74 PolarHBondContact O-N 2.76Å
75	F	52.3	Low	58	Low	73 Å²	73	70.9 Å²	70.9	32%	0.32	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-128.6	29	-179.3	-64.9	-81	0	0	0	113.7	T72 D73 A80	T72-F75 PolarHBondContact O-N 3.38Å; D73-F75 VanDerWaalsContact C-N 3.27Å; D73-F75 PolarHBondContact O-N 3.49Å; F75-A80 WeakPolarHBondContact O-CB 3.36Å
76	T	52	Low	61	Low	67 Å²	67	69.7 Å²	69.7	41%	0.411	42%	0.423	S	S	.	.			trans	-98.3	11.7	-170.3	61.5	0	0	0	0	115.9	I71 T72 D73	I71-T76 HydrophobicContact CG2-CG2 3.16Å; T72-T76 WeakPolarHBondContact O-CG2 3.39Å; D73-T76 PolarHBondContact O-OG1 2.97Å
77	G	57.8	Low	64	Low	50 Å²	50	67.1 Å²	67.1	52%	0.515	41%	0.407	S	S	.	.	S	Bend	trans	-69.8	176.6	177.4	0	0	0	0	0	114.1	G79 A80	G77-G79 PolarHBondContact O-N 3.15Å; G77-G79 VanDerWaalsContact O-N 3.08Å; G77-A80 WeakPolarHBondContact O-CB 3.3Å; G77-A80 PolarHBondContact O-N 2.83Å
78	A	58.3	Low	66.9	Low	105 Å²	105	68.3 Å²	68.3	87%	0.868	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-54.6	-26.6	172.2	0	0	0	0	0	113	A80	A78-A80 VanDerWaalsContact C-N 3.31Å; A78-A80 PolarHBondContact O-N 2.94Å
79	G	70.7	Confident	69.7	Low	11 Å²	11	67.7 Å²	67.7	11%	0.113	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-75.3	-4.4	173.3	0	0	0	0	0	116.2	G77 V81 E98	G77-G79 PolarHBondContact O-N 3.15Å; G77-G79 VanDerWaalsContact O-N 3.08Å; G79-V81 PolarHBondContact O-N 2.9Å; G79-E98 CarbonylContact C-O 3.41Å
80	A	83	Confident	72.5	Confident	10 Å²	10	66.8 Å²	66.8	8%	0.083	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-66.5	-18.9	-179.1	0	0	0	0	0	113.8	F75 G77 A78 L147 N148	F75-A80 WeakPolarHBondContact O-CB 3.36Å; G77-A80 WeakPolarHBondContact O-CB 3.3Å; G77-A80 PolarHBondContact O-N 2.83Å; A78-A80 VanDerWaalsContact C-N 3.31Å; A78-A80 PolarHBondContact O-N 2.94Å; A80-L147 HydrophobicContact CB-CD1 4.4Å; A80-N148 WeakPolarHBondContact O-CB 3.41Å; A80-N148 PolarHBondContact O-N 3.47Å
81	V	91.5	Very high	75.1	Confident	37 Å²	37	57.9 Å²	57.9	22%	0.224	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	113.2	-172.6	-176	0	0	0	0	109.7	G79 R145 V146 L147	G79-V81 PolarHBondContact O-N 2.9Å; V81-R145 HydrophobicContact CG1-CB 3.88Å; V81-R145 HydrophobicContact CG1-CG 4.25Å; V81-V146 CarbonylContact C-O 3.58Å; V81-V146 WeakPolarHBondContact CA-O 3.24Å; V81-L147 HydrophobicContact CG2-CD1 4.21Å
82	G	93.6	Very high	77.8	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.01	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	178.9	170.6	0	0	0	0	0	112.6	R95 R145 V146	G82-R95 CarbonylContact C-O 3.59Å; G82-R95 WeakPolarHBondContact CA-O 3.37Å; G82-R145 WeakPolarHBondContact O-CA 3.49Å; G82-V146 PolarHBondContact N-O 3.45Å; G82-V146 PolarHBondContact O-N 3.46Å
83	Q	94.9	Very high	80.3	Confident	75 Å²	75	49.7 Å²	49.7	35%	0.35	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	138.7	176.9	-64.7	176.4	9	0	0	110.8	C85 V94 R95 Q144	Q83-C85 PolarHBondContact O-N 3.3Å; Q83-V94 WeakPolarHBondContact O-CA 3.34Å; Q83-R95 PolarHBondContact N-O 3.44Å; Q83-R95 PolarHBondContact O-N 3.44Å; Q83-Q144 CarbonylContact C-O 3.56Å; Q83-Q144 WeakPolarHBondContact CA-O 3.29Å
84	V	96.3	Very high	82.9	Confident	2 Å²	2	43 Å²	43	1%	0.012	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	120.9	173.8	177.4	0	0	0	0	109.8	V87 V92 L140 R142 G143 Q144 V146	V84-V87 HydrophobicContact CG1-CG2 3.66Å; V84-V92 HydrophobicContact CG1-CG1 3.91Å; V84-V92 HydrophobicContact CG2-CG1 4.15Å; V84-L140 HydrophobicContact CG1-CD2 4.19Å; V84-L140 HydrophobicContact CG1-CG 4.39Å; V84-L140 HydrophobicContact CG2-CD1 4.22Å; V84-L140 HydrophobicContact CG2-CD2 4.25Å; V84-L140 HydrophobicContact CG2-CG 4.27Å; V84-R142 CarbonylContact O-C 3.56Å; V84-R142 WeakPolarHBondContact O-CA 3.23Å; V84-G143 PolarHBondContact O-N 3.43Å; V84-Q144 HydrophobicContact CG2-CB 4.19Å; V84-Q144 PolarHBondContact N-O 2.86Å; V84-V146 HydrophobicContact CG2-CG2 3.58Å
85	C	95.1	Very high	85.1	Confident	32 Å²	32	39.5 Å²	39.5	22%	0.216	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-42.4	175.9	-67	0	0	0	0	112	Q83 D93 R95 M128 R142	Q83-C85 PolarHBondContact O-N 3.3Å; C85-D93 PolarHBondContact N-O 2.94Å; C85-R95 WeakPolarHBondContact SG-CB 3.47Å; C85-M128 HydrophobicContact CB-CE 4.02Å; C85-M128 HydrophobicContact CB-SD 4.45Å; C85-R142 VanDerWaalsContact O-CD 3.3Å; C85-R142 WeakPolarHBondContact O-CD 3.5Å; C85-R142 WeakPolarHBondContact O-CG 3.43Å; C85-R142 PolarHBondContact O-NE 3.46Å
86	Q	94.7	Very high	87.1	Confident	82 Å²	82	36.1 Å²	36.1	38%	0.383	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	148.5	-174.8	-171.2	172.3	0.8	0	0	110.9	I88 V92 D93	Q86-I88 HydrophobicContact CG-CD1 4.35Å; Q86-I88 HydrophobicContact CG-CG1 4.04Å; Q86-V92 WeakPolarHBondContact O-CA 3.42Å; Q86-D93 HydrophobicContact CB-CB 4.14Å; Q86-D93 PolarHBondContact N-O 3.3Å; Q86-D93 PolarHBondContact O-N 3.45Å
87	V	94.3	Very high	88.9	Confident	50 Å²	50	37.8 Å²	37.8	30%	0.303	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	122.5	178.4	-173.6	0	0	0	0	107.6	V84 V92 L140	V84-V87 HydrophobicContact CG1-CG2 3.66Å; V87-V92 HydrophobicContact CG1-CG2 4.4Å; V87-L140 HydrophobicContact CG1-CD2 4.27Å; V87-L140 HydrophobicContact CG2-CB 4.42Å; V87-L140 HydrophobicContact CG2-CD2 3.65Å; V87-L140 HydrophobicContact CG2-CG 4.15Å
88	I	91.1	Very high	90.2	Very high	69 Å²	69	41.8 Å²	41.8	35%	0.354	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	89.8	179.6	-53.3	171.3	0	0	0	107.9	Q86 A90 V91	Q86-I88 HydrophobicContact CG-CD1 4.35Å; Q86-I88 HydrophobicContact CG-CG1 4.04Å; I88-A90 PolarHBondContact O-N 2.93Å; I88-V91 PolarHBondContact N-O 3.45Å; I88-V91 WeakPolarHBondContact O-CB 3.45Å; I88-V91 PolarHBondContact O-N 3.37Å
89	G	89.1	Confident	91.4	Very high	49 Å²	49	39.3 Å²	39.3	51%	0.505	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	-126.6	-173.1	0	0	0	0	0	110.5	V91 T137	G89-V91 PolarHBondContact O-N 3.15Å; G89-T137 PolarHBondContact O-OG1 3.36Å
90	A	92.1	Very high	92.3	Very high	10 Å²	10	41.5 Å²	41.5	8%	0.083	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-1.1	177.4	0	0	0	0	0	114.8	I88 A133 P298 P299 L344	I88-A90 PolarHBondContact O-N 2.93Å; A90-A133 WeakPolarHBondContact O-CB 3.45Å; A90-A133 PolarHBondContact O-N 3.36Å; A90-P298 HydrophobicContact CB-CB 4.12Å; A90-P299 HydrophobicContact CB-CG 4.24Å; A90-L344 HydrophobicContact CB-CD1 4.11Å
91	V	95.4	Very high	92.7	Very high	1 Å²	1	41 Å²	41	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	127.5	178.5	170.9	0	0	0	0	110.1	I88 G89 R130 T131 L344 L345	I88-V91 PolarHBondContact N-O 3.45Å; I88-V91 WeakPolarHBondContact O-CB 3.45Å; I88-V91 PolarHBondContact O-N 3.37Å; G89-V91 PolarHBondContact O-N 3.15Å; V91-R130 VanDerWaalsContact CG1-CD 3.45Å; V91-R130 HydrophobicContact CG1-CG 3.52Å; V91-T131 WeakPolarHBondContact CA-O 3.35Å; V91-L344 HydrophobicContact CG2-CB 3.58Å; V91-L344 HydrophobicContact CG2-CD1 4.48Å; V91-L345 HydrophobicContact CG2-CD2 4.31Å
92	V	96.4	Very high	92.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	123.2	-179.2	-177.5	0	0	0	0	109	V84 Q86 V87 V94 L118 T131 T137 L140	V84-V92 HydrophobicContact CG1-CG1 3.91Å; V84-V92 HydrophobicContact CG2-CG1 4.15Å; Q86-V92 WeakPolarHBondContact O-CA 3.42Å; V87-V92 HydrophobicContact CG1-CG2 4.4Å; V92-V94 HydrophobicContact CG1-CG2 4Å; V92-L118 HydrophobicContact CB-CD1 4.06Å; V92-L118 HydrophobicContact CB-CD2 4.3Å; V92-L118 HydrophobicContact CG1-CD1 3.93Å; V92-L118 HydrophobicContact CG2-CD2 4.02Å; V92-T131 PolarHBondContact N-O 3.08Å; V92-T131 WeakPolarHBondContact O-CA 3.39Å; V92-T131 WeakPolarHBondContact O-CB 3.22Å; V92-T131 PolarHBondContact O-N 3.09Å; V92-T131 PolarHBondContact O-OG1 2.92Å; V92-T137 HydrophobicContact CG2-CG2 4.04Å; V92-L140 HydrophobicContact CB-CD2 4.36Å; V92-L140 HydrophobicContact CG1-CD2 3.72Å; V92-L140 HydrophobicContact CG2-CD2 3.63Å
93	D	97	Very high	92.8	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.011	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	126.5	174.5	-64.9	-20.9	0	0	0	108.8	C85 Q86 L124 M128 V129 R130	C85-D93 PolarHBondContact N-O 2.94Å; Q86-D93 HydrophobicContact CB-CB 4.14Å; Q86-D93 PolarHBondContact N-O 3.3Å; Q86-D93 PolarHBondContact O-N 3.45Å; D93-L124 HydrophobicContact CB-CD1 4.26Å; D93-M128 HydrophobicContact CB-CG 4.31Å; D93-M128 HydrophobicContact CB-SD 3.89Å; D93-V129 CarbonylContact C-O 3.6Å; D93-V129 WeakPolarHBondContact CA-O 3.24Å; D93-R130 WeakPolarHBondContact OD1-CA 3.35Å; D93-R130 VanDerWaalsContact OD1-CB 3.24Å; D93-R130 WeakPolarHBondContact OD1-CB 3.04Å; D93-R130 VanDerWaalsContact OD1-CG 3.25Å; D93-R130 WeakPolarHBondContact OD1-CG 3.41Å; D93-R130 IonicContact OD1-CZ 3.31Å; D93-R130 IonicContact OD1-NE 3.74Å; D93-R130 PolarHBondContact OD1-NE 3.01Å; D93-R130 IonicContact OD1-NH2 3.6Å; D93-R130 IonicContact OD2-CZ 2.94Å; D93-R130 IonicContact OD2-NE 3.48Å; D93-R130 IonicContact OD2-NH2 2.91Å; D93-R130 PolarHBondContact OD2-NH2 3.04Å
94	V	96.8	Very high	92.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	130.2	-175.4	-175.1	0	0	0	0	108.9	Q83 V92 F96 L107 L118 M128 V129 T131 V146	Q83-V94 WeakPolarHBondContact O-CA 3.34Å; V92-V94 HydrophobicContact CG1-CG2 4Å; V94-F96 HydrophobicContact CB-CE2 4.08Å; V94-F96 HydrophobicContact CG1-CD2 4.12Å; V94-F96 HydrophobicContact CG1-CE2 3.47Å; V94-F96 VanDerWaalsContact CG1-CE2 3.47Å; V94-F96 HydrophobicContact CG1-CZ 3.93Å; V94-L107 HydrophobicContact CB-CD1 4.48Å; V94-L107 HydrophobicContact CG2-CD1 4.39Å; V94-L118 HydrophobicContact CG2-CD1 4.06Å; V94-M128 WeakPolarHBondContact O-CA 3.45Å; V94-V129 HydrophobicContact CB-CG2 4.03Å; V94-V129 PolarHBondContact N-O 2.93Å; V94-V129 WeakPolarHBondContact O-CG2 3.44Å; V94-V129 PolarHBondContact O-N 2.96Å; V94-T131 HydrophobicContact CG2-CG2 4.45Å; V94-V146 HydrophobicContact CG1-CB 3.8Å; V94-V146 HydrophobicContact CG1-CG1 4.1Å; V94-V146 HydrophobicContact CG1-CG2 3.99Å; V94-V146 HydrophobicContact CG2-CG1 4.38Å; V94-V146 HydrophobicContact CG2-CG2 4.13Å
95	R	95.6	Very high	92.8	Very high	104 Å²	104	46.4 Å²	46.4	39%	0.392	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132.7	174.7	-177.8	179	67.9	-161.8	-2.1	110.5	G82 Q83 C85	G82-R95 CarbonylContact C-O 3.59Å; G82-R95 WeakPolarHBondContact CA-O 3.37Å; Q83-R95 PolarHBondContact N-O 3.44Å; Q83-R95 PolarHBondContact O-N 3.44Å; C85-R95 WeakPolarHBondContact SG-CB 3.47Å
96	F	94	Very high	92.8	Very high	1 Å²	1	45.1 Å²	45.1	0%	0.004	26%	0.256	C	S	.	.			trans	-108.5	135.7	172.1	-71.4	-95.1	0	0	0	108.6	V94 P101 L107 N127 V129 N148	V94-F96 HydrophobicContact CB-CE2 4.08Å; V94-F96 HydrophobicContact CG1-CD2 4.12Å; V94-F96 HydrophobicContact CG1-CE2 3.47Å; V94-F96 VanDerWaalsContact CG1-CE2 3.47Å; V94-F96 HydrophobicContact CG1-CZ 3.93Å; F96-P101 HydrophobicContact CD1-CG 4.22Å; F96-P101 HydrophobicContact CD2-CG 3.87Å; F96-P101 HydrophobicContact CE1-CG 3.95Å; F96-P101 HydrophobicContact CE2-CG 3.58Å; F96-P101 HydrophobicContact CG-CG 4.19Å; F96-P101 HydrophobicContact CZ-CG 3.63Å; F96-L107 HydrophobicContact CE2-CD1 3.93Å; F96-L107 HydrophobicContact CE2-CD2 4.49Å; F96-L107 HydrophobicContact CZ-CD1 3.92Å; F96-L107 HydrophobicContact CZ-CD2 3.93Å; F96-N127 PolarHBondContact N-O 2.89Å; F96-N127 WeakPolarHBondContact O-CB 3.36Å; F96-V129 HydrophobicContact CD2-CG2 4.22Å; F96-V129 HydrophobicContact CE2-CG2 3.86Å; F96-N148 HydrophobicContact CE1-CB 3.91Å; F96-N148 HydrophobicContact CZ-CB 4.33Å
97	D	89.1	Confident	92.9	Very high	103 Å²	103	41.2 Å²	41.2	55%	0.551	24%	0.237	S	C	*	.	S	Bend	trans	-75.4	-35.1	179.7	-66.6	-31.5	0	0	0	111	N127	D97-N127 PolarHBondContact O-ND2 2.69Å
98	E	84.9	Confident	92.9	Very high	134 Å²	134	40.1 Å²	40.1	63%	0.626	23%	0.229	S	C	*	.	S	Bend	trans	-140.7	156.1	174.5	-64	-179.1	174.1	0	0	109.6	G79	G79-E98 CarbonylContact C-O 3.41Å
99	G	83.3	Confident	93.1	Very high	52 Å²	52	37.2 Å²	37.2	54%	0.536	21%	0.214	S	C	.	.			trans	69.8	64.2	171.6	0	0	0	0	0	114.7	P101	G99-P101 WeakPolarHBondContact O-CD 3.42Å
100	L	89.2	Confident	93.2	Very high	58 Å²	58	36.9 Å²	36.9	30%	0.304	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-57.6	120.5	179	-166.4	68.7	0	0	0	111.5	H123 N127 V129	L100-H123 HydrophobicContact CD2-CB 4.22Å; L100-N127 HydrophobicContact CD1-CB 4.46Å; L100-N127 WeakPolarHBondContact CD1-O 3.43Å; L100-V129 HydrophobicContact CD1-CG1 3.39Å; L100-V129 HydrophobicContact CG-CG1 3.93Å
101	P	92.6	Very high	93	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-64.6	137.7	-179.7	-21.6	32	0	0	0	112.1	F96 G99 T105 L107 V120 H123 N148	F96-P101 HydrophobicContact CD1-CG 4.22Å; F96-P101 HydrophobicContact CD2-CG 3.87Å; F96-P101 HydrophobicContact CE1-CG 3.95Å; F96-P101 HydrophobicContact CE2-CG 3.58Å; F96-P101 HydrophobicContact CG-CG 4.19Å; F96-P101 HydrophobicContact CZ-CG 3.63Å; G99-P101 WeakPolarHBondContact O-CD 3.42Å; P101-T105 HydrophobicContact CB-CG2 4.3Å; P101-L107 HydrophobicContact CB-CD2 4.05Å; P101-L107 HydrophobicContact CG-CD2 3.9Å; P101-V120 HydrophobicContact CB-CG2 4.16Å; P101-H123 PolarHBondContact O-NE2 2.95Å; P101-N148 HydrophobicContact CG-CB 4.19Å
102	P	93.2	Very high	92.7	Very high	63 Å²	63	44.8 Å²	44.8	41%	0.409	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-59.5	160.1	173.3	-23.5	33.3	0	0	0	113.2	T105	P102-T105 WeakPolarHBondContact CD-OG1 3.25Å; P102-T105 VanDerWaalsContact O-CB 3.24Å; P102-T105 WeakPolarHBondContact O-CB 3.45Å; P102-T105 PolarHBondContact O-N 2.86Å; P102-T105 PolarHBondContact O-OG1 3.31Å
103	I	94.6	Very high	92.2	Very high	94 Å²	94	52.3 Å²	52.3	48%	0.482	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	145.8	171.8	-54.8	177.2	0	0	0	109.4	T105	I103-T105 PolarHBondContact O-N 3.09Å
104	L	95.1	Very high	91.8	Very high	63 Å²	63	55.4 Å²	55.4	33%	0.33	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	-0.7	-174.9	-48.5	178.5	0	0	0	115.7	V120 P152 H188	L104-V120 PolarHBondContact N-O 2.9Å; L104-P152 VanDerWaalsContact O-CA 3.29Å; L104-P152 WeakPolarHBondContact O-CA 3.48Å; L104-P152 WeakPolarHBondContact O-CB 3.41Å; L104-H188 HydrophobicContact CD1-CB 4.01Å
105	T	95.4	Very high	91.6	Very high	8 Å²	8	59.6 Å²	59.6	5%	0.049	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	137.9	174.8	-50.9	0	0	0	0	110.4	P101 P102 I103 V120 N148	P101-T105 HydrophobicContact CB-CG2 4.3Å; P102-T105 WeakPolarHBondContact CD-OG1 3.25Å; P102-T105 VanDerWaalsContact O-CB 3.24Å; P102-T105 WeakPolarHBondContact O-CB 3.45Å; P102-T105 PolarHBondContact O-N 2.86Å; P102-T105 PolarHBondContact O-OG1 3.31Å; I103-T105 PolarHBondContact O-N 3.09Å; T105-V120 WeakPolarHBondContact O-CG2 3.21Å; T105-V120 PolarHBondContact O-N 3.15Å; T105-N148 WeakPolarHBondContact CG2-OD1 3.41Å
106	A	95.8	Very high	91.6	Very high	5 Å²	5	54.7 Å²	54.7	4%	0.041	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	136.7	172.8	0	0	0	0	0	110.5	V117 L118 T149 S151 I153	A106-V117 HydrophobicContact CB-CG1 4.08Å; A106-L118 CarbonylContact C-O 3.57Å; A106-L118 WeakPolarHBondContact CA-O 3.17Å; A106-T149 HydrophobicContact CB-CG2 4.4Å; A106-T149 WeakPolarHBondContact O-CB 3.34Å; A106-T149 WeakPolarHBondContact O-CG2 3.49Å; A106-T149 PolarHBondContact O-N 3.34Å; A106-T149 VanDerWaalsContact O-N 3.12Å; A106-T149 PolarHBondContact O-OG1 2.77Å; A106-S151 WeakPolarHBondContact CB-O 3.32Å; A106-S151 PolarHBondContact N-O 3.37Å; A106-I153 HydrophobicContact CB-CG1 3.8Å
107	L	95.7	Very high	91.7	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	144.7	172.8	-44.6	178.9	0	0	0	109.1	V94 F96 P101 V117 L118 V120 V129 T131 V146 L147 N148	V94-L107 HydrophobicContact CB-CD1 4.48Å; V94-L107 HydrophobicContact CG2-CD1 4.39Å; F96-L107 HydrophobicContact CE2-CD1 3.93Å; F96-L107 HydrophobicContact CE2-CD2 4.49Å; F96-L107 HydrophobicContact CZ-CD1 3.92Å; F96-L107 HydrophobicContact CZ-CD2 3.93Å; P101-L107 HydrophobicContact CB-CD2 4.05Å; P101-L107 HydrophobicContact CG-CD2 3.9Å; L107-V117 CarbonylContact O-C 3.46Å; L107-V117 WeakPolarHBondContact O-CA 3.33Å; L107-L118 HydrophobicContact CB-CB 4.25Å; L107-L118 PolarHBondContact N-O 3.38Å; L107-L118 PolarHBondContact O-N 3.39Å; L107-V120 HydrophobicContact CD1-CG2 3.88Å; L107-V120 HydrophobicContact CD2-CG2 4.1Å; L107-V120 HydrophobicContact CG-CG2 3.92Å; L107-V129 HydrophobicContact CD1-CG2 4.16Å; L107-T131 HydrophobicContact CD1-CG2 3.59Å; L107-V146 HydrophobicContact CB-CG1 3.53Å; L107-V146 HydrophobicContact CD1-CG1 4.02Å; L107-V146 HydrophobicContact CG-CG1 4.38Å; L107-L147 CarbonylContact C-O 3.57Å; L107-L147 VanDerWaalsContact CA-O 3.22Å; L107-L147 WeakPolarHBondContact CA-O 3.27Å; L107-N148 HydrophobicContact CD2-CB 4.05Å
108	E	95	Very high	92	Very high	27 Å²	27	50.1 Å²	50.1	13%	0.126	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.6	-179.4	-171.1	165.8	168.2	0	0	109.9	L110 R115 V146 L147 T149	E108-L110 PolarHBondContact O-N 3.3Å; E108-R115 IonicContact OE1-NE 2.76Å; E108-R115 PolarHBondContact OE1-NE 3.46Å; E108-R115 IonicContact OE2-NE 3.27Å; E108-R115 IonicContact OE2-NH2 2.74Å; E108-V146 CarbonylContact O-C 3.53Å; E108-V146 WeakPolarHBondContact O-CA 3.47Å; E108-L147 PolarHBondContact N-O 3.48Å; E108-L147 PolarHBondContact O-N 3.47Å; E108-T149 HydrophobicContact CB-CG2 4.31Å
109	V	94.9	Very high	92.6	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.042	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	123.3	176.5	-175.9	0	0	0	0	109.2	H112 L116 L118 L140 Q144 V146	V109-H112 HydrophobicContact CB-CB 4.42Å; V109-H112 HydrophobicContact CG1-CB 3.98Å; V109-L116 HydrophobicContact CB-CB 4.2Å; V109-L116 HydrophobicContact CG2-CB 4.12Å; V109-L116 HydrophobicContact CG2-CD2 3.96Å; V109-L116 HydrophobicContact CG2-CG 4.04Å; V109-L116 PolarHBondContact N-O 3.04Å; V109-L118 HydrophobicContact CG2-CD1 3.76Å; V109-L118 HydrophobicContact CG2-CD2 4.44Å; V109-L118 HydrophobicContact CG2-CG 3.97Å; V109-L140 HydrophobicContact CB-CD1 4.42Å; V109-L140 HydrophobicContact CG1-CD1 3.57Å; V109-L140 HydrophobicContact CG2-CD1 4.09Å; V109-Q144 HydrophobicContact CG1-CG 3.83Å; V109-V146 HydrophobicContact CG2-CG2 4.34Å
110	L	92.1	Very high	93.3	Very high	42 Å²	42	41.3 Å²	41.3	22%	0.22	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	152.1	178.4	-57.7	-179.9	0	0	0	110.9	E108 H112 Q144 R145 L147	E108-L110 PolarHBondContact O-N 3.3Å; L110-H112 PolarHBondContact O-N 2.97Å; L110-Q144 PolarHBondContact O-NE2 3.36Å; L110-R145 HydrophobicContact CB-CB 4.16Å; L110-R145 HydrophobicContact CD1-CB 4.01Å; L110-R145 HydrophobicContact CG-CB 4.45Å; L110-R145 PolarHBondContact N-O 3.44Å; L110-L147 HydrophobicContact CD1-CB 4.31Å; L110-L147 HydrophobicContact CD2-CB 3.95Å; L110-L147 HydrophobicContact CD2-CD2 4.45Å; L110-L147 HydrophobicContact CG-CB 4.16Å
111	D	87.5	Confident	93.5	Very high	144 Å²	144	39.3 Å²	39.3	77%	0.77	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	32.1	174.8	-51.7	-48.6	0	0	0	113.8	Q144	D111-Q144 PolarHBondContact O-NE2 2.94Å
112	H	88.2	Confident	93.6	Very high	34 Å²	34	41.8 Å²	41.8	16%	0.157	22%	0.218	C	C	.	.			trans	-101.2	156.1	176.1	-163.4	50.8	0	0	0	111.7	V109 L110 I114 E138	V109-H112 HydrophobicContact CB-CB 4.42Å; V109-H112 HydrophobicContact CG1-CB 3.98Å; L110-H112 PolarHBondContact O-N 2.97Å; H112-I114 VanDerWaalsContact C-N 3.25Å; H112-I114 PolarHBondContact CD2-O 3.12Å; H112-I114 PolarHBondContact O-N 3.33Å; H112-E138 PolarHBondContact CE1-O 3.17Å; H112-E138 VanDerWaalsContact CE1-O 3.24Å
113	N	86.4	Confident	93.7	Very high	158 Å²	158	42.9 Å²	42.9	85%	0.845	22%	0.218	S	C	*	.	S	Bend	trans	-66.3	-30.4	-175.1	-67	-21.8	0	0	0	112.9
114	I	88.7	Confident	93.6	Very high	67 Å²	67	41.8 Å²	41.8	34%	0.344	21%	0.212	S	C	.	.	S	Bend	trans	-122.8	158.2	175.6	61.7	172	0	0	0	108.8	H112 L116 D135	H112-I114 VanDerWaalsContact C-N 3.25Å; H112-I114 PolarHBondContact CD2-O 3.12Å; H112-I114 PolarHBondContact O-N 3.33Å; I114-L116 PolarHBondContact O-N 3.48Å; I114-D135 HydrophobicContact CD1-CB 4.26Å
115	R	92.2	Very high	93.4	Very high	88 Å²	88	40.7 Å²	40.7	33%	0.332	22%	0.217	S	C	.	.			trans	-73.8	91.6	174	-169.6	-168.3	-177	-158.9	-7.2	109.6	E108 E171	E108-R115 IonicContact OE1-NE 2.76Å; E108-R115 PolarHBondContact OE1-NE 3.46Å; E108-R115 IonicContact OE2-NE 3.27Å; E108-R115 IonicContact OE2-NH2 2.74Å; R115-E171 WeakPolarHBondContact CD-OE1 3.4Å; R115-E171 IonicContact CZ-OE1 3.71Å; R115-E171 IonicContact NE-OE1 3.38Å; R115-E171 IonicContact NH1-OE1 3.74Å; R115-E171 PolarHBondContact NH1-OE1 3.35Å
116	L	94.8	Very high	93.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.254	C	S	.	.			trans	-90.8	112.9	-179.4	-178.4	61	0	0	0	110.5	V109 I114 L118 A133 D135 T137 L140	V109-L116 HydrophobicContact CB-CB 4.2Å; V109-L116 HydrophobicContact CG2-CB 4.12Å; V109-L116 HydrophobicContact CG2-CD2 3.96Å; V109-L116 HydrophobicContact CG2-CG 4.04Å; V109-L116 PolarHBondContact N-O 3.04Å; I114-L116 PolarHBondContact O-N 3.48Å; L116-L118 HydrophobicContact CD1-CD2 4.41Å; L116-L118 HydrophobicContact CD2-CD2 4.23Å; L116-L118 HydrophobicContact CG-CD2 4Å; L116-A133 HydrophobicContact CD1-CB 4.16Å; L116-D135 HydrophobicContact CD1-CB 3.88Å; L116-T137 HydrophobicContact CD2-CG2 4.49Å; L116-L140 HydrophobicContact CD2-CD1 4.19Å
117	V	96.4	Very high	93	Very high	9 Å²	9	52.3 Å²	52.3	6%	0.055	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	131.5	174.1	-178.4	0	0	0	0	109.6	A106 L107 M134 I153 I169	A106-V117 HydrophobicContact CB-CG1 4.08Å; L107-V117 CarbonylContact O-C 3.46Å; L107-V117 WeakPolarHBondContact O-CA 3.33Å; V117-M134 HydrophobicContact CB-CB 4.48Å; V117-M134 HydrophobicContact CB-CG 4.44Å; V117-M134 HydrophobicContact CG1-CG 4.46Å; V117-M134 WeakPolarHBondContact O-CB 3.18Å; V117-M134 PolarHBondContact O-N 3.11Å; V117-I153 HydrophobicContact CG1-CD1 4.3Å; V117-I153 HydrophobicContact CG1-CG1 4.12Å; V117-I169 HydrophobicContact CB-CG2 4.04Å; V117-I169 HydrophobicContact CG1-CG2 4.33Å; V117-I169 HydrophobicContact CG2-CD1 4.03Å; V117-I169 HydrophobicContact CG2-CG2 4.1Å
118	L	97	Very high	92.9	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	137.7	175.4	-48.9	175.9	0	0	0	109.1	V92 V94 A106 L107 V109 L116 T131 I132 A133 V146	V92-L118 HydrophobicContact CB-CD1 4.06Å; V92-L118 HydrophobicContact CB-CD2 4.3Å; V92-L118 HydrophobicContact CG1-CD1 3.93Å; V92-L118 HydrophobicContact CG2-CD2 4.02Å; V94-L118 HydrophobicContact CG2-CD1 4.06Å; A106-L118 CarbonylContact C-O 3.57Å; A106-L118 WeakPolarHBondContact CA-O 3.17Å; L107-L118 HydrophobicContact CB-CB 4.25Å; L107-L118 PolarHBondContact N-O 3.38Å; L107-L118 PolarHBondContact O-N 3.39Å; V109-L118 HydrophobicContact CG2-CD1 3.76Å; V109-L118 HydrophobicContact CG2-CD2 4.44Å; V109-L118 HydrophobicContact CG2-CG 3.97Å; L116-L118 HydrophobicContact CD1-CD2 4.41Å; L116-L118 HydrophobicContact CD2-CD2 4.23Å; L116-L118 HydrophobicContact CG-CD2 4Å; L118-T131 HydrophobicContact CB-CG2 4.34Å; L118-I132 CarbonylContact C-O 3.5Å; L118-I132 WeakPolarHBondContact CA-O 3.49Å; L118-A133 HydrophobicContact CD2-CB 3.69Å; L118-V146 HydrophobicContact CD1-CG1 4.37Å
119	E	97.2	Very high	93	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	129.4	174.5	-177	-174.6	90	0	0	110.3	A121 T131 I132 M134 I153 H188 R304	E119-A121 PolarHBondContact O-N 3.46Å; E119-T131 CarbonylContact O-C 3.47Å; E119-T131 WeakPolarHBondContact O-CA 3.46Å; E119-T131 VanDerWaalsContact O-CB 3.25Å; E119-T131 WeakPolarHBondContact O-CB 3.44Å; E119-I132 PolarHBondContact N-O 3.19Å; E119-I132 PolarHBondContact O-N 3.29Å; E119-M134 HydrophobicContact CB-CE 3.78Å; E119-I153 HydrophobicContact CB-CD1 4.31Å; E119-H188 IonicContact OE1-NE2 2.81Å; E119-H188 IonicContact OE2-CD2 3.31Å; E119-H188 IonicContact OE2-CE1 3.01Å; E119-H188 IonicContact OE2-NE2 3.34Å; E119-H188 PolarHBondContact OE2-NE2 3.4Å; E119-R304 IonicContact OE1-CZ 3.96Å; E119-R304 IonicContact OE1-NE 2.97Å; E119-R304 PolarHBondContact OE1-NE 2.8Å; E119-R304 IonicContact OE1-NH2 3.98Å; E119-R304 PolarHBondContact OE1-NH2 2.78Å; E119-R304 IonicContact OE2-NE 3.78Å; E119-R304 PolarHBondContact OE2-NE 2.91Å
120	V	96.6	Very high	93.1	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	119.4	177.3	179.3	0	0	0	0	110.7	P101 L104 T105 L107 V129 T131	P101-V120 HydrophobicContact CB-CG2 4.16Å; L104-V120 PolarHBondContact N-O 2.9Å; T105-V120 WeakPolarHBondContact O-CG2 3.21Å; T105-V120 PolarHBondContact O-N 3.15Å; L107-V120 HydrophobicContact CD1-CG2 3.88Å; L107-V120 HydrophobicContact CD2-CG2 4.1Å; L107-V120 HydrophobicContact CG-CG2 3.92Å; V120-V129 HydrophobicContact CG1-CB 4.01Å; V120-V129 HydrophobicContact CG1-CG1 4.14Å; V120-V129 HydrophobicContact CG2-CB 4.49Å; V120-V129 HydrophobicContact CG2-CG2 4.23Å; V120-T131 HydrophobicContact CB-CG2 4.45Å; V120-T131 HydrophobicContact CG2-CG2 3.93Å
121	A	94.9	Very high	93.3	Very high	16 Å²	16	52.4 Å²	52.4	13%	0.132	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	-35.9	-178.4	0	0	0	0	0	113.3	E119 R130 I132 L345	E119-A121 PolarHBondContact O-N 3.46Å; A121-R130 PolarHBondContact N-O 3.38Å; A121-I132 HydrophobicContact CB-CD1 3.72Å; A121-I132 HydrophobicContact CB-CG1 3.99Å; A121-L345 HydrophobicContact CB-CD1 4.27Å; A121-L345 HydrophobicContact CB-CD2 3.93Å
122	Q	94.1	Very high	93.7	Very high	52 Å²	52	45.7 Å²	45.7	24%	0.243	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	158.4	179.1	62	-178	25.4	0	0	112.1	L124 V129 R130	Q122-L124 HydrophobicContact CG-CD2 4.32Å; Q122-L124 VanDerWaalsContact NE2-CD2 3.32Å; Q122-V129 WeakPolarHBondContact O-CA 3.35Å; Q122-R130 HydrophobicContact CG-CB 3.55Å; Q122-R130 HydrophobicContact CG-CG 4.18Å; Q122-R130 PolarHBondContact N-O 3.02Å; Q122-R130 PolarHBondContact O-N 2.94Å
123	H	95.3	Very high	94.1	Very high	87 Å²	87	44.1 Å²	44.1	40%	0.403	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	129.4	170.6	-62.3	170	0	0	0	109.6	L100 P101	L100-H123 HydrophobicContact CD2-CB 4.22Å; P101-H123 PolarHBondContact O-NE2 2.95Å
124	L	92	Very high	94.6	Very high	70 Å²	70	37 Å²	37	37%	0.366	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-15	-178	-65.3	178.6	0	0	0	113.2	D93 Q122 M128 R130	D93-L124 HydrophobicContact CB-CD1 4.26Å; Q122-L124 HydrophobicContact CG-CD2 4.32Å; Q122-L124 VanDerWaalsContact NE2-CD2 3.32Å; L124-M128 HydrophobicContact CB-CB 4.23Å; L124-M128 HydrophobicContact CD1-CG 4.01Å; L124-M128 HydrophobicContact CD1-SD 3.74Å; L124-M128 PolarHBondContact N-O 2.88Å; L124-R130 HydrophobicContact CD1-CB 4.04Å; L124-R130 HydrophobicContact CD2-CB 4.21Å; L124-R130 HydrophobicContact CG-CB 4.04Å
125	G	91.3	Very high	94.8	Very high	41 Å²	41	37 Å²	37	42%	0.423	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	96.1	174.4	-166.8	0	0	0	0	0	111.8	N127 M128	G125-N127 PolarHBondContact O-N 3.23Å; G125-N127 VanDerWaalsContact O-N 3.12Å; G125-M128 VanDerWaalsContact O-CB 3.29Å; G125-M128 WeakPolarHBondContact O-CB 3.3Å; G125-M128 PolarHBondContact O-N 3.14Å
126	E	90.1	Very high	94.8	Very high	180 Å²	180	33.5 Å²	33.5	84%	0.841	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.3	35.9	-179.5	-56.9	-177.9	-178.8	0	0	113.8	M128	E126-M128 PolarHBondContact O-N 3.33Å
127	N	92.1	Very high	94.7	Very high	76 Å²	76	34.8 Å²	34.8	41%	0.406	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	28.1	-172.5	-55.6	-23.4	0	0	0	115	F96 D97 L100 G125	F96-N127 PolarHBondContact N-O 2.89Å; F96-N127 WeakPolarHBondContact O-CB 3.36Å; D97-N127 PolarHBondContact O-ND2 2.69Å; L100-N127 HydrophobicContact CD1-CB 4.46Å; L100-N127 WeakPolarHBondContact CD1-O 3.43Å; G125-N127 PolarHBondContact O-N 3.23Å; G125-N127 VanDerWaalsContact O-N 3.12Å
128	M	94.9	Very high	94.5	Very high	37 Å²	37	41.7 Å²	41.7	18%	0.182	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	136.4	176.1	-165.6	-178.7	-61.8	0	0	111	C85 D93 V94 L124 G125 E126	C85-M128 HydrophobicContact CB-CE 4.02Å; C85-M128 HydrophobicContact CB-SD 4.45Å; D93-M128 HydrophobicContact CB-CG 4.31Å; D93-M128 HydrophobicContact CB-SD 3.89Å; V94-M128 WeakPolarHBondContact O-CA 3.45Å; L124-M128 HydrophobicContact CB-CB 4.23Å; L124-M128 HydrophobicContact CD1-CG 4.01Å; L124-M128 HydrophobicContact CD1-SD 3.74Å; L124-M128 PolarHBondContact N-O 2.88Å; G125-M128 VanDerWaalsContact O-CB 3.29Å; G125-M128 WeakPolarHBondContact O-CB 3.3Å; G125-M128 PolarHBondContact O-N 3.14Å; E126-M128 PolarHBondContact O-N 3.33Å
129	V	96.1	Very high	94.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	143.4	170.9	-60.1	0	0	0	0	109.8	D93 V94 F96 L100 L107 V120 Q122 T131	D93-V129 CarbonylContact C-O 3.6Å; D93-V129 WeakPolarHBondContact CA-O 3.24Å; V94-V129 HydrophobicContact CB-CG2 4.03Å; V94-V129 PolarHBondContact N-O 2.93Å; V94-V129 WeakPolarHBondContact O-CG2 3.44Å; V94-V129 PolarHBondContact O-N 2.96Å; F96-V129 HydrophobicContact CD2-CG2 4.22Å; F96-V129 HydrophobicContact CE2-CG2 3.86Å; L100-V129 HydrophobicContact CD1-CG1 3.39Å; L100-V129 HydrophobicContact CG-CG1 3.93Å; L107-V129 HydrophobicContact CD1-CG2 4.16Å; V120-V129 HydrophobicContact CG1-CB 4.01Å; V120-V129 HydrophobicContact CG1-CG1 4.14Å; V120-V129 HydrophobicContact CG2-CB 4.49Å; V120-V129 HydrophobicContact CG2-CG2 4.23Å; Q122-V129 WeakPolarHBondContact O-CA 3.35Å; V129-T131 HydrophobicContact CG2-CG2 3.85Å
130	R	96.9	Very high	94	Very high	41 Å²	41	45.4 Å²	45.4	16%	0.155	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	130	166.9	174.7	161	-63.5	167.8	-0.2	109	V91 D93 A121 Q122 L124 L345	V91-R130 VanDerWaalsContact CG1-CD 3.45Å; V91-R130 HydrophobicContact CG1-CG 3.52Å; D93-R130 WeakPolarHBondContact OD1-CA 3.35Å; D93-R130 VanDerWaalsContact OD1-CB 3.24Å; D93-R130 WeakPolarHBondContact OD1-CB 3.04Å; D93-R130 VanDerWaalsContact OD1-CG 3.25Å; D93-R130 WeakPolarHBondContact OD1-CG 3.41Å; D93-R130 IonicContact OD1-CZ 3.31Å; D93-R130 IonicContact OD1-NE 3.74Å; D93-R130 PolarHBondContact OD1-NE 3.01Å; D93-R130 IonicContact OD1-NH2 3.6Å; D93-R130 IonicContact OD2-CZ 2.94Å; D93-R130 IonicContact OD2-NE 3.48Å; D93-R130 IonicContact OD2-NH2 2.91Å; D93-R130 PolarHBondContact OD2-NH2 3.04Å; A121-R130 PolarHBondContact N-O 3.38Å; Q122-R130 HydrophobicContact CG-CB 3.55Å; Q122-R130 HydrophobicContact CG-CG 4.18Å; Q122-R130 PolarHBondContact N-O 3.02Å; Q122-R130 PolarHBondContact O-N 2.94Å; L124-R130 HydrophobicContact CD1-CB 4.04Å; L124-R130 HydrophobicContact CD2-CB 4.21Å; L124-R130 HydrophobicContact CG-CB 4.04Å; R130-L345 HydrophobicContact CG-CD2 3.8Å; R130-L345 PolarHBondContact NH1-O 3.36Å
131	T	97.1	Very high	93.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	159.8	-176.3	68.9	0	0	0	0	111.8	V91 V92 V94 L107 L118 E119 V120 V129	V91-T131 WeakPolarHBondContact CA-O 3.35Å; V92-T131 PolarHBondContact N-O 3.08Å; V92-T131 WeakPolarHBondContact O-CA 3.39Å; V92-T131 WeakPolarHBondContact O-CB 3.22Å; V92-T131 PolarHBondContact O-N 3.09Å; V92-T131 PolarHBondContact O-OG1 2.92Å; V94-T131 HydrophobicContact CG2-CG2 4.45Å; L107-T131 HydrophobicContact CD1-CG2 3.59Å; L118-T131 HydrophobicContact CB-CG2 4.34Å; E119-T131 CarbonylContact O-C 3.47Å; E119-T131 WeakPolarHBondContact O-CA 3.46Å; E119-T131 VanDerWaalsContact O-CB 3.25Å; E119-T131 WeakPolarHBondContact O-CB 3.44Å; V120-T131 HydrophobicContact CB-CG2 4.45Å; V120-T131 HydrophobicContact CG2-CG2 3.93Å; V129-T131 HydrophobicContact CG2-CG2 3.85Å
132	I	96.4	Very high	93.8	Very high	4 Å²	4	57.9 Å²	57.9	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127.3	174.3	-58	156.8	0	0	0	107.9	L118 E119 A121 M134 V341 L345	L118-I132 CarbonylContact C-O 3.5Å; L118-I132 WeakPolarHBondContact CA-O 3.49Å; E119-I132 PolarHBondContact N-O 3.19Å; E119-I132 PolarHBondContact O-N 3.29Å; A121-I132 HydrophobicContact CB-CD1 3.72Å; A121-I132 HydrophobicContact CB-CG1 3.99Å; I132-M134 HydrophobicContact CB-CE 4.17Å; I132-M134 HydrophobicContact CG2-CE 3.98Å; I132-M134 VanDerWaalsContact O-CE 3.26Å; I132-M134 WeakPolarHBondContact O-CE 3.37Å; I132-V341 HydrophobicContact CD1-CG1 3.35Å; I132-V341 HydrophobicContact CG1-CG1 4.01Å; I132-V341 HydrophobicContact CG2-CG2 4.38Å; I132-L345 HydrophobicContact CD1-CD1 4.4Å; I132-L345 HydrophobicContact CG1-CD2 4.31Å
133	A	96.2	Very high	93.8	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	136.5	176	0	0	0	0	0	111.9	A90 L116 L118 D135 T137	A90-A133 WeakPolarHBondContact O-CB 3.45Å; A90-A133 PolarHBondContact O-N 3.36Å; L116-A133 HydrophobicContact CD1-CB 4.16Å; L118-A133 HydrophobicContact CD2-CB 3.69Å; A133-D135 WeakPolarHBondContact CB-O 3.34Å; A133-T137 HydrophobicContact CB-CG2 3.43Å; A133-T137 VanDerWaalsContact CB-CG2 3.43Å
134	M	95.6	Very high	93.7	Very high	8 Å²	8	54.6 Å²	54.6	4%	0.039	30%	0.303	C	S	.	.	S	Bend	trans	-87.8	-8.4	174.7	-61	-59.7	116.7	0	0	113	V117 E119 I132 I153 V168 I169 A301 R304	V117-M134 HydrophobicContact CB-CB 4.48Å; V117-M134 HydrophobicContact CB-CG 4.44Å; V117-M134 HydrophobicContact CG1-CG 4.46Å; V117-M134 WeakPolarHBondContact O-CB 3.18Å; V117-M134 PolarHBondContact O-N 3.11Å; E119-M134 HydrophobicContact CB-CE 3.78Å; I132-M134 HydrophobicContact CB-CE 4.17Å; I132-M134 HydrophobicContact CG2-CE 3.98Å; I132-M134 VanDerWaalsContact O-CE 3.26Å; I132-M134 WeakPolarHBondContact O-CE 3.37Å; M134-I153 HydrophobicContact CG-CD1 3.74Å; M134-I153 HydrophobicContact SD-CD1 3.88Å; M134-V168 HydrophobicContact CB-CG1 4.1Å; M134-V168 HydrophobicContact SD-CG2 4.41Å; M134-I169 HydrophobicContact CB-CG2 4.13Å; M134-I169 HydrophobicContact CG-CG2 4.25Å; M134-A301 WeakPolarHBondContact O-CB 3.11Å; M134-R304 HydrophobicContact CE-CG 4.28Å; M134-R304 HydrophobicContact SD-CB 4.29Å; M134-R304 HydrophobicContact SD-CG 4Å
135	D	94.5	Very high	93.8	Very high	69 Å²	69	57.2 Å²	57.2	37%	0.369	31%	0.308	S	S	.	.	S	Bend	trans	-143.6	177.9	175.8	-152	-17.7	0	0	0	110.3	I114 L116 A133 T137	I114-D135 HydrophobicContact CD1-CB 4.26Å; L116-D135 HydrophobicContact CD1-CB 3.88Å; A133-D135 WeakPolarHBondContact CB-O 3.34Å; D135-T137 PolarHBondContact O-N 3.48Å
136	G	92.3	Very high	94	Very high	14 Å²	14	55.3 Å²	55.3	14%	0.144	29%	0.288	C	S	.	.			trans	-52.2	136.1	177.2	0	0	0	0	0	112.3	E138	G136-E138 WeakPolarHBondContact CA-OE2 3.42Å
137	T	92.3	Very high	94.2	Very high	26 Å²	26	48.4 Å²	48.4	16%	0.16	26%	0.256	C	S	.	.			trans	-96.6	14.2	179	60.8	0	0	0	0	112.2	G89 V92 L116 A133 D135 G139 L140	G89-T137 PolarHBondContact O-OG1 3.36Å; V92-T137 HydrophobicContact CG2-CG2 4.04Å; L116-T137 HydrophobicContact CD2-CG2 4.49Å; A133-T137 HydrophobicContact CB-CG2 3.43Å; A133-T137 VanDerWaalsContact CB-CG2 3.43Å; D135-T137 PolarHBondContact O-N 3.48Å; T137-G139 PolarHBondContact O-N 3.28Å; T137-L140 WeakPolarHBondContact O-CB 3.38Å; T137-L140 PolarHBondContact O-N 2.91Å
138	E	91.8	Very high	94.2	Very high	154 Å²	154	45.2 Å²	45.2	72%	0.72	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	131.8	-179.5	-63.5	96.3	171.2	0	0	111.6	H112 G136 L140	H112-E138 PolarHBondContact CE1-O 3.17Å; H112-E138 VanDerWaalsContact CE1-O 3.24Å; G136-E138 WeakPolarHBondContact CA-OE2 3.42Å; E138-L140 VanDerWaalsContact C-N 3.31Å
139	G	91.6	Very high	94.1	Very high	58 Å²	58	44.5 Å²	44.5	60%	0.598	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.3	2.2	-179.7	0	0	0	0	0	114.7	T137	T137-G139 PolarHBondContact O-N 3.28Å
140	L	92.3	Very high	93.7	Very high	21 Å²	21	45.4 Å²	45.4	11%	0.11	25%	0.246	C	C	.	.			trans	-69.4	131.2	171.7	-164	72.9	0	0	0	110.7	V84 V87 V92 V109 L116 T137 E138	V84-L140 HydrophobicContact CG1-CD2 4.19Å; V84-L140 HydrophobicContact CG1-CG 4.39Å; V84-L140 HydrophobicContact CG2-CD1 4.22Å; V84-L140 HydrophobicContact CG2-CD2 4.25Å; V84-L140 HydrophobicContact CG2-CG 4.27Å; V87-L140 HydrophobicContact CG1-CD2 4.27Å; V87-L140 HydrophobicContact CG2-CB 4.42Å; V87-L140 HydrophobicContact CG2-CD2 3.65Å; V87-L140 HydrophobicContact CG2-CG 4.15Å; V92-L140 HydrophobicContact CB-CD2 4.36Å; V92-L140 HydrophobicContact CG1-CD2 3.72Å; V92-L140 HydrophobicContact CG2-CD2 3.63Å; V109-L140 HydrophobicContact CB-CD1 4.42Å; V109-L140 HydrophobicContact CG1-CD1 3.57Å; V109-L140 HydrophobicContact CG2-CD1 4.09Å; L116-L140 HydrophobicContact CD2-CD1 4.19Å; T137-L140 WeakPolarHBondContact O-CB 3.38Å; T137-L140 PolarHBondContact O-N 2.91Å; E138-L140 VanDerWaalsContact C-N 3.31Å
141	V	93.2	Very high	93.5	Very high	94 Å²	94	45 Å²	45	57%	0.57	25%	0.25	S	C	*	.			trans	-119.7	147	-176.5	-173.6	0	0	0	0	111.1	Q144	V141-Q144 WeakPolarHBondContact O-CB 3.31Å; V141-Q144 PolarHBondContact O-N 3.31Å; V141-Q144 VanDerWaalsContact O-N 3.13Å
142	R	94.2	Very high	93.4	Very high	184 Å²	184	47 Å²	47	69%	0.694	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	138.6	172.9	-61.9	-176.1	-176.6	-179.4	-1.7	110.8	V84 C85 Q144	V84-R142 CarbonylContact O-C 3.56Å; V84-R142 WeakPolarHBondContact O-CA 3.23Å; C85-R142 VanDerWaalsContact O-CD 3.3Å; C85-R142 WeakPolarHBondContact O-CD 3.5Å; C85-R142 WeakPolarHBondContact O-CG 3.43Å; C85-R142 PolarHBondContact O-NE 3.46Å; R142-Q144 VanDerWaalsContact C-N 3.27Å
143	G	93.1	Very high	93.3	Very high	41 Å²	41	47.2 Å²	47.2	42%	0.423	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	-5.3	-173.8	0	0	0	0	0	114	V84	V84-G143 PolarHBondContact O-N 3.43Å
144	Q	93.7	Very high	93.3	Very high	29 Å²	29	50 Å²	50	14%	0.136	28%	0.281	C	S	.	.			trans	-62.5	138.6	174.1	-173.1	160.7	7.9	0	0	110.5	Q83 V84 V109 L110 D111 V141 R142	Q83-Q144 CarbonylContact C-O 3.56Å; Q83-Q144 WeakPolarHBondContact CA-O 3.29Å; V84-Q144 HydrophobicContact CG2-CB 4.19Å; V84-Q144 PolarHBondContact N-O 2.86Å; V109-Q144 HydrophobicContact CG1-CG 3.83Å; L110-Q144 PolarHBondContact O-NE2 3.36Å; D111-Q144 PolarHBondContact O-NE2 2.94Å; V141-Q144 WeakPolarHBondContact O-CB 3.31Å; V141-Q144 PolarHBondContact O-N 3.31Å; V141-Q144 VanDerWaalsContact O-N 3.13Å; R142-Q144 VanDerWaalsContact C-N 3.27Å
145	R	94.8	Very high	93.3	Very high	125 Å²	125	49.6 Å²	49.6	47%	0.472	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	139.7	-174.5	-64.1	174.5	66.7	-158.8	-1	110.5	V81 G82 L110	V81-R145 HydrophobicContact CG1-CB 3.88Å; V81-R145 HydrophobicContact CG1-CG 4.25Å; G82-R145 WeakPolarHBondContact O-CA 3.49Å; L110-R145 HydrophobicContact CB-CB 4.16Å; L110-R145 HydrophobicContact CD1-CB 4.01Å; L110-R145 HydrophobicContact CG-CB 4.45Å; L110-R145 PolarHBondContact N-O 3.44Å
146	V	95	Very high	93.4	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	123.2	-179.8	-179.8	0	0	0	0	108.4	V81 G82 V84 V94 L107 E108 V109 L118	V81-V146 CarbonylContact C-O 3.58Å; V81-V146 WeakPolarHBondContact CA-O 3.24Å; G82-V146 PolarHBondContact N-O 3.45Å; G82-V146 PolarHBondContact O-N 3.46Å; V84-V146 HydrophobicContact CG2-CG2 3.58Å; V94-V146 HydrophobicContact CG1-CB 3.8Å; V94-V146 HydrophobicContact CG1-CG1 4.1Å; V94-V146 HydrophobicContact CG1-CG2 3.99Å; V94-V146 HydrophobicContact CG2-CG1 4.38Å; V94-V146 HydrophobicContact CG2-CG2 4.13Å; L107-V146 HydrophobicContact CB-CG1 3.53Å; L107-V146 HydrophobicContact CD1-CG1 4.02Å; L107-V146 HydrophobicContact CG-CG1 4.38Å; E108-V146 CarbonylContact O-C 3.53Å; E108-V146 WeakPolarHBondContact O-CA 3.47Å; V109-V146 HydrophobicContact CG2-CG2 4.34Å; L118-V146 HydrophobicContact CD1-CG1 4.37Å
147	L	94	Very high	93.6	Very high	35 Å²	35	46 Å²	46	18%	0.183	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	129.6	178.8	179.7	66	0	0	0	110.4	A80 V81 L107 E108 L110	A80-L147 HydrophobicContact CB-CD1 4.4Å; V81-L147 HydrophobicContact CG2-CD1 4.21Å; L107-L147 CarbonylContact C-O 3.57Å; L107-L147 VanDerWaalsContact CA-O 3.22Å; L107-L147 WeakPolarHBondContact CA-O 3.27Å; E108-L147 PolarHBondContact N-O 3.48Å; E108-L147 PolarHBondContact O-N 3.47Å; L110-L147 HydrophobicContact CD1-CB 4.31Å; L110-L147 HydrophobicContact CD2-CB 3.95Å; L110-L147 HydrophobicContact CD2-CD2 4.45Å; L110-L147 HydrophobicContact CG-CB 4.16Å
148	N	93.6	Very high	93.6	Very high	9 Å²	9	44.9 Å²	44.9	5%	0.048	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	119.5	165	-179.5	7.4	0	0	0	109.8	A80 F96 P101 T105 L107 G150	A80-N148 WeakPolarHBondContact O-CB 3.41Å; A80-N148 PolarHBondContact O-N 3.47Å; F96-N148 HydrophobicContact CE1-CB 3.91Å; F96-N148 HydrophobicContact CZ-CB 4.33Å; P101-N148 HydrophobicContact CG-CB 4.19Å; T105-N148 WeakPolarHBondContact CG2-OD1 3.41Å; L107-N148 HydrophobicContact CD2-CB 4.05Å; N148-G150 VanDerWaalsContact C-N 3.28Å; N148-G150 PolarHBondContact O-N 3.38Å; N148-G150 PolarHBondContact OD1-N 3.23Å
149	T	91	Very high	93.6	Very high	22 Å²	22	44.4 Å²	44.4	14%	0.135	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-14.5	179.1	69.5	0	0	0	0	113.2	T72 A106 E108 S151	T72-T149 PolarHBondContact OG1-O 2.96Å; A106-T149 HydrophobicContact CB-CG2 4.4Å; A106-T149 WeakPolarHBondContact O-CB 3.34Å; A106-T149 WeakPolarHBondContact O-CG2 3.49Å; A106-T149 PolarHBondContact O-N 3.34Å; A106-T149 VanDerWaalsContact O-N 3.12Å; A106-T149 PolarHBondContact O-OG1 2.77Å; E108-T149 HydrophobicContact CB-CG2 4.31Å; T149-S151 PolarHBondContact O-N 3.08Å; T149-S151 PolarHBondContact OG1-N 2.97Å; T149-S151 PolarHBondContact OG1-O 2.86Å
150	G	89.1	Confident	93.6	Very high	19 Å²	19	43 Å²	43	20%	0.196	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	76.3	-2.5	-178.2	0	0	0	0	0	115	N148	N148-G150 VanDerWaalsContact C-N 3.28Å; N148-G150 PolarHBondContact O-N 3.38Å; N148-G150 PolarHBondContact OD1-N 3.23Å
151	S	91.8	Very high	93.6	Very high	33 Å²	33	42 Å²	42	23%	0.231	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	160.3	-179.9	59.2	0	0	0	0	111.7	A106 T149	A106-S151 WeakPolarHBondContact CB-O 3.32Å; A106-S151 PolarHBondContact N-O 3.37Å; T149-S151 PolarHBondContact O-N 3.08Å; T149-S151 PolarHBondContact OG1-N 2.97Å; T149-S151 PolarHBondContact OG1-O 2.86Å
152	P	94.6	Very high	93.6	Very high	43 Å²	43	37.6 Å²	37.6	28%	0.279	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	169.4	168.4	-20.3	33.3	0	0	0	111.8	L104 T154 P186	L104-P152 VanDerWaalsContact O-CA 3.29Å; L104-P152 WeakPolarHBondContact O-CA 3.48Å; L104-P152 WeakPolarHBondContact O-CB 3.41Å; P152-T154 WeakPolarHBondContact O-CG2 3.24Å; P152-T154 PolarHBondContact O-N 3.36Å; P152-P186 HydrophobicContact CB-CB 4.18Å; P152-P186 HydrophobicContact CG-CB 4.39Å
153	I	95.9	Very high	93.5	Very high	7 Å²	7	28.9 Å²	28.9	4%	0.036	16%	0.161	C	C	.	.			trans	-55.9	119.6	172.9	-60.4	172.8	0	0	0	108.8	A106 V117 E119 M134 I169 P186 I187	A106-I153 HydrophobicContact CB-CG1 3.8Å; V117-I153 HydrophobicContact CG1-CD1 4.3Å; V117-I153 HydrophobicContact CG1-CG1 4.12Å; E119-I153 HydrophobicContact CB-CD1 4.31Å; M134-I153 HydrophobicContact CG-CD1 3.74Å; M134-I153 HydrophobicContact SD-CD1 3.88Å; I153-I169 HydrophobicContact CG2-CB 4.39Å; I153-I169 HydrophobicContact CG2-CG2 4.12Å; I153-P186 WeakPolarHBondContact O-CA 3.48Å; I153-I187 HydrophobicContact CB-CD1 3.77Å; I153-I187 HydrophobicContact CB-CG1 4.03Å; I153-I187 HydrophobicContact CD1-CD1 4.03Å; I153-I187 HydrophobicContact CG1-CD1 4.4Å; I153-I187 HydrophobicContact CG2-CD1 4.1Å; I153-I187 HydrophobicContact CG2-CG2 4.29Å; I153-I187 PolarHBondContact O-N 3.32Å
154	T	95.6	Very high	93.6	Very high	59 Å²	59	27.4 Å²	27.4	36%	0.362	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	136.2	178.1	59.4	0	0	0	0	111.1	P152 L185	P152-T154 WeakPolarHBondContact O-CG2 3.24Å; P152-T154 PolarHBondContact O-N 3.36Å; T154-L185 CarbonylContact C-O 3.28Å; T154-L185 VanDerWaalsContact CA-O 3.32Å; T154-L185 WeakPolarHBondContact CA-O 3.46Å
155	V	96.2	Very high	93.7	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	148.7	-176.9	-66.2	0	0	0	0	110.7	V157 F184 L185 I187 T308 T311	V155-V157 HydrophobicContact CG2-CG1 4.31Å; V155-F184 VanDerWaalsContact O-CA 3.3Å; V155-F184 WeakPolarHBondContact O-CA 3.31Å; V155-L185 PolarHBondContact N-O 3.12Å; V155-L185 PolarHBondContact O-N 2.9Å; V155-L185 VanDerWaalsContact O-N 3.07Å; V155-I187 HydrophobicContact CB-CG2 4.44Å; V155-I187 HydrophobicContact CG1-CG2 3.62Å; V155-I187 HydrophobicContact CG2-CG2 3.99Å; V155-T308 HydrophobicContact CB-CG2 4.19Å; V155-T308 HydrophobicContact CG1-CG2 3.61Å; V155-T308 HydrophobicContact CG2-CG2 4.28Å; V155-T311 HydrophobicContact CG2-CG2 3.98Å
156	P	96.5	Very high	93.7	Very high	6 Å²	6	20.9 Å²	20.9	4%	0.039	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	138.4	174.2	28.8	-31.6	0	0	0	110	T161 G170 I179 T181 F184	P156-T161 VanDerWaalsContact O-CG2 3.32Å; P156-T161 WeakPolarHBondContact O-CG2 3.38Å; P156-G170 VanDerWaalsContact CD-O 3.32Å; P156-G170 WeakPolarHBondContact CD-O 3.32Å; P156-G170 WeakPolarHBondContact CG-O 3.49Å; P156-I179 HydrophobicContact CB-CG2 4.06Å; P156-I179 HydrophobicContact CG-CD1 4.22Å; P156-I179 HydrophobicContact CG-CG2 4.33Å; P156-T181 HydrophobicContact CB-CG2 3.35Å; P156-F184 HydrophobicContact CB-CD1 4.32Å; P156-F184 HydrophobicContact CB-CE1 3.9Å; P156-F184 HydrophobicContact CB-CZ 4.41Å
157	V	95	Very high	93.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.123	C	C	.	.			trans	-132.3	168.6	179.2	-60.9	0	0	0	0	111.8	V155 T181 H183 L185 T311 V312 H315	V155-V157 HydrophobicContact CG2-CG1 4.31Å; V157-T181 PolarHBondContact O-OG1 3.29Å; V157-T181 VanDerWaalsContact O-OG1 3.1Å; V157-H183 HydrophobicContact CG2-CB 3.77Å; V157-H183 WeakPolarHBondContact CG2-O 3.19Å; V157-H183 PolarHBondContact N-O 3.03Å; V157-L185 HydrophobicContact CB-CD1 4.46Å; V157-L185 HydrophobicContact CG1-CB 4.11Å; V157-L185 HydrophobicContact CG1-CD1 4.15Å; V157-L185 HydrophobicContact CG1-CG 4.3Å; V157-L185 HydrophobicContact CG2-CB 4.41Å; V157-L185 HydrophobicContact CG2-CD1 3.86Å; V157-L185 HydrophobicContact CG2-CG 3.81Å; V157-T311 HydrophobicContact CG1-CG2 4.39Å; V157-V312 HydrophobicContact CG1-CG2 4.31Å; V157-H315 HydrophobicContact CB-CB 3.75Å; V157-H315 HydrophobicContact CG1-CB 4.31Å; V157-H315 HydrophobicContact CG2-CB 3.97Å; V157-H315 WeakPolarHBondContact CG2-ND1 3.42Å
158	G	92.1	Very high	93.7	Very high	3 Å²	3	20.4 Å²	20.4	3%	0.031	12%	0.115	C	C	.	.	S	Bend	trans	93.8	-174.8	-179.7	0	0	0	0	0	113.5	A160 T161 H315	G158-A160 PolarHBondContact O-N 3.5Å; G158-T161 PolarHBondContact O-N 3.44Å; G158-T161 PolarHBondContact O-OG1 2.97Å; G158-H315 WeakPolarHBondContact CA-CD2 3.44Å; G158-H315 WeakPolarHBondContact CA-NE2 3.12Å; G158-H315 PolarHBondContact N-CD2 3.14Å
159	R	91.8	Very high	93.8	Very high	145 Å²	145	20.8 Å²	20.8	55%	0.547	12%	0.117	S	C	.	.	G	3₁₀ helix	trans	-58.2	-19.9	-172	-60.3	-173.6	177.7	-164.6	-3.5	115.3	T161 L162 F316 E320	R159-T161 PolarHBondContact O-N 2.99Å; R159-L162 HydrophobicContact CB-CD1 3.99Å; R159-L162 HydrophobicContact CG-CD1 4.13Å; R159-L162 WeakPolarHBondContact O-CB 3.39Å; R159-L162 PolarHBondContact O-N 2.94Å; R159-L162 VanDerWaalsContact O-N 3.17Å; R159-F316 HydrophobicContact CG-CE1 4.21Å; R159-E320 VanDerWaalsContact CG-OE1 3.27Å; R159-E320 WeakPolarHBondContact CG-OE1 3.38Å; R159-E320 IonicContact CZ-OE2 3.96Å; R159-E320 VanDerWaalsContact CZ-OE2 3.3Å; R159-E320 IonicContact NE-OE1 3.53Å; R159-E320 PolarHBondContact NE-OE1 3.5Å; R159-E320 IonicContact NE-OE2 2.86Å; R159-E320 PolarHBondContact NE-OE2 3.47Å; R159-E320 IonicContact NH2-OE2 2.95Å; R159-E320 PolarHBondContact NH2-OE2 3.42Å
160	A	91.9	Very high	93.9	Very high	29 Å²	29	20 Å²	20	24%	0.24	11%	0.113	C	C	.	.	G	3₁₀ helix	trans	-63	-23.1	174.6	0	0	0	0	0	113.1	G158 R164 I179	G158-A160 PolarHBondContact O-N 3.5Å; A160-R164 WeakPolarHBondContact O-CG 3.46Å; A160-I179 HydrophobicContact CB-CG2 3.9Å
161	T	93.7	Very high	94.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-81.6	-14.5	177.4	67.8	0	0	0	0	113.2	P156 G158 R159 G163 R164 M166 I179 A289	P156-T161 VanDerWaalsContact O-CG2 3.32Å; P156-T161 WeakPolarHBondContact O-CG2 3.38Å; G158-T161 PolarHBondContact O-N 3.44Å; G158-T161 PolarHBondContact O-OG1 2.97Å; R159-T161 PolarHBondContact O-N 2.99Å; T161-G163 PolarHBondContact O-N 3.39Å; T161-R164 WeakPolarHBondContact O-CB 3.24Å; T161-R164 PolarHBondContact O-N 3.07Å; T161-M166 HydrophobicContact CG2-CE 3.88Å; T161-I179 HydrophobicContact CG2-CG2 4.48Å; T161-A289 WeakPolarHBondContact O-CB 3Å
162	L	92.8	Very high	94.3	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	133.2	-179.4	-62.9	170	0	0	0	110.6	R159 R164 F251 Q283 F316	R159-L162 HydrophobicContact CB-CD1 3.99Å; R159-L162 HydrophobicContact CG-CD1 4.13Å; R159-L162 WeakPolarHBondContact O-CB 3.39Å; R159-L162 PolarHBondContact O-N 2.94Å; R159-L162 VanDerWaalsContact O-N 3.17Å; L162-R164 PolarHBondContact O-N 3.41Å; L162-F251 HydrophobicContact CD1-CD1 3.81Å; L162-F251 HydrophobicContact CD1-CE1 3.49Å; L162-F251 VanDerWaalsContact CD1-CE1 3.49Å; L162-F251 HydrophobicContact CD1-CZ 4.17Å; L162-F251 HydrophobicContact CD2-CD1 3.82Å; L162-F251 HydrophobicContact CD2-CE1 4.38Å; L162-F251 HydrophobicContact CD2-CG 4.4Å; L162-Q283 WeakPolarHBondContact O-CG 3.33Å; L162-Q283 PolarHBondContact O-NE2 3.42Å; L162-F316 HydrophobicContact CD1-CE1 4.49Å; L162-F316 HydrophobicContact CD1-CZ 4.37Å; L162-F316 HydrophobicContact CD2-CE2 4.25Å; L162-F316 HydrophobicContact CD2-CZ 3.82Å; L162-F316 HydrophobicContact CG-CZ 3.99Å
163	G	92.1	Very high	94.2	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.01	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	73	4.4	-176.3	0	0	0	0	0	114.5	T161 C288	T161-G163 PolarHBondContact O-N 3.39Å; G163-C288 PolarHBondContact N-O 3.25Å
164	R	94.5	Very high	94	Very high	9 Å²	9	24.1 Å²	24.1	3%	0.034	13%	0.126	C	C	.	.			trans	-105.6	155.4	-178.6	-55.9	-58.5	-57.7	-80.6	-5.8	111.3	A160 T161 L162 P172 D174 G177 D178 I179 Q283 L290	A160-R164 WeakPolarHBondContact O-CG 3.46Å; T161-R164 WeakPolarHBondContact O-CB 3.24Å; T161-R164 PolarHBondContact O-N 3.07Å; L162-R164 PolarHBondContact O-N 3.41Å; R164-P172 VanDerWaalsContact NH2-CB 3.34Å; R164-D174 WeakPolarHBondContact CA-OD2 3.44Å; R164-D174 IonicContact CZ-OD1 2.96Å; R164-D174 IonicContact CZ-OD2 3.73Å; R164-D174 IonicContact NE-OD1 3.82Å; R164-D174 IonicContact NE-OD2 2.87Å; R164-D174 PolarHBondContact NE-OD2 3.48Å; R164-D174 IonicContact NH2-OD1 3.3Å; R164-D174 PolarHBondContact NH2-OD1 3.06Å; R164-D174 IonicContact NH2-OD2 2.69Å; R164-D174 PolarHBondContact NH2-OD2 2.97Å; R164-G177 PolarHBondContact NH2-O 3.4Å; R164-D178 PolarHBondContact NH1-O 3.02Å; R164-D178 VanDerWaalsContact NH1-O 3.16Å; R164-I179 HydrophobicContact CB-CD1 4.23Å; R164-I179 HydrophobicContact CB-CG1 4.47Å; R164-I179 HydrophobicContact CG-CG1 4.42Å; R164-Q283 VanDerWaalsContact CD-CD 3.48Å; R164-Q283 VanDerWaalsContact CG-NE2 3.35Å; R164-L290 PolarHBondContact O-N 3.06Å
165	I	94.9	Very high	93.7	Very high	17 Å²	17	30 Å²	30	9%	0.087	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	125.4	171.9	-51	172.4	0	0	0	109.3	P172 I173 D174 Y268 L290 Y292	I165-P172 VanDerWaalsContact O-CA 3.3Å; I165-P172 WeakPolarHBondContact O-CA 3.48Å; I165-I173 HydrophobicContact CB-CG1 4.06Å; I165-I173 HydrophobicContact CG2-CD1 3.75Å; I165-I173 HydrophobicContact CG2-CG1 3.51Å; I165-I173 PolarHBondContact O-N 3.18Å; I165-D174 HydrophobicContact CB-CB 3.95Å; I165-D174 HydrophobicContact CD1-CB 4.05Å; I165-D174 HydrophobicContact CG1-CB 4.05Å; I165-D174 PolarHBondContact N-OD2 3.34Å; I165-Y268 HydrophobicContact CD1-CD1 3.86Å; I165-Y268 HydrophobicContact CD1-CD2 3.74Å; I165-Y268 HydrophobicContact CD1-CE1 3.91Å; I165-Y268 HydrophobicContact CD1-CE2 3.81Å; I165-Y268 HydrophobicContact CD1-CG 3.77Å; I165-Y268 HydrophobicContact CG1-CD2 4.04Å; I165-Y268 HydrophobicContact CG1-CE2 3.89Å; I165-L290 CarbonylContact C-O 3.57Å; I165-L290 WeakPolarHBondContact CA-O 3.17Å; I165-L290 HydrophobicContact CG1-CB 4.24Å; I165-L290 HydrophobicContact CG2-CB 4.4Å; I165-Y292 HydrophobicContact CG2-CD2 3.34Å; I165-Y292 HydrophobicContact CG2-CE2 3.7Å
166	M	95.7	Very high	93.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	153.5	176.1	71.9	-168.8	96.6	0	0	112.8	T161 E171 I179 A289 L290 V291 Y292 V312	T161-M166 HydrophobicContact CG2-CE 3.88Å; M166-E171 CarbonylContact C-O 3.59Å; M166-E171 VanDerWaalsContact CA-O 3.22Å; M166-E171 WeakPolarHBondContact CA-O 3.16Å; M166-I179 HydrophobicContact CB-CD1 4.35Å; M166-A289 HydrophobicContact CE-CB 4.4Å; M166-L290 PolarHBondContact N-O 2.99Å; M166-V291 HydrophobicContact CE-CG2 3.87Å; M166-V291 HydrophobicContact CG-CB 4.15Å; M166-V291 HydrophobicContact CG-CG1 4Å; M166-V291 HydrophobicContact CG-CG2 3.71Å; M166-V291 WeakPolarHBondContact O-CA 3.32Å; M166-V291 HydrophobicContact SD-CG2 3.85Å; M166-Y292 PolarHBondContact O-N 2.9Å; M166-V312 HydrophobicContact CE-CG2 3.89Å; M166-V312 HydrophobicContact SD-CG2 3.98Å
167	N	95	Very high	93	Very high	21 Å²	21	37.9 Å²	37.9	11%	0.112	20%	0.195	C	C	.	.			trans	-85	-177	170.6	69.6	10.5	0	0	0	111.7	I169 G170 E171 I173	N167-I169 VanDerWaalsContact C-N 3.26Å; N167-I169 PolarHBondContact O-N 3.35Å; N167-I169 WeakPolarHBondContact OD1-CG1 3.3Å; N167-I169 PolarHBondContact OD1-N 3.11Å; N167-I169 VanDerWaalsContact OD1-N 3.15Å; N167-G170 PolarHBondContact O-N 2.86Å; N167-G170 PolarHBondContact OD1-N 2.82Å; N167-E171 PolarHBondContact N-O 3.44Å; N167-E171 PolarHBondContact OD1-N 3.34Å; N167-E171 PolarHBondContact OD1-O 3.14Å; N167-I173 HydrophobicContact CB-CG2 3.95Å
168	V	94.6	Very high	92.8	Very high	4 Å²	4	43 Å²	43	2%	0.024	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-33.3	-179.4	63.9	0	0	0	0	114.2	M134 G170 A301 R304 V305 T308	M134-V168 HydrophobicContact CB-CG1 4.1Å; M134-V168 HydrophobicContact SD-CG2 4.41Å; V168-G170 VanDerWaalsContact C-N 3.35Å; V168-A301 HydrophobicContact CB-CB 4.41Å; V168-A301 HydrophobicContact CG1-CB 3.92Å; V168-R304 HydrophobicContact CG2-CB 3.55Å; V168-V305 HydrophobicContact CG2-CB 4.49Å; V168-T308 PolarHBondContact O-OG1 3.44Å
169	I	94.7	Very high	92.7	Very high	17 Å²	17	43.9 Å²	43.9	9%	0.087	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	3.1	178.4	60	171.8	0	0	0	113.2	V117 M134 I153 N167 E171	V117-I169 HydrophobicContact CB-CG2 4.04Å; V117-I169 HydrophobicContact CG1-CG2 4.33Å; V117-I169 HydrophobicContact CG2-CD1 4.03Å; V117-I169 HydrophobicContact CG2-CG2 4.1Å; M134-I169 HydrophobicContact CB-CG2 4.13Å; M134-I169 HydrophobicContact CG-CG2 4.25Å; I153-I169 HydrophobicContact CG2-CB 4.39Å; I153-I169 HydrophobicContact CG2-CG2 4.12Å; N167-I169 VanDerWaalsContact C-N 3.26Å; N167-I169 PolarHBondContact O-N 3.35Å; N167-I169 WeakPolarHBondContact OD1-CG1 3.3Å; N167-I169 PolarHBondContact OD1-N 3.11Å; N167-I169 VanDerWaalsContact OD1-N 3.15Å; I169-E171 HydrophobicContact CD1-CG 4.03Å; I169-E171 WeakPolarHBondContact CD1-OE2 3.43Å; I169-E171 HydrophobicContact CG1-CG 4.04Å
170	G	94	Very high	92.5	Very high	6 Å²	6	43 Å²	43	6%	0.062	24%	0.237	C	C	.	.	S	Bend	trans	86.5	10.1	174.6	0	0	0	0	0	115.2	P156 N167 V168	P156-G170 VanDerWaalsContact CD-O 3.32Å; P156-G170 WeakPolarHBondContact CD-O 3.32Å; P156-G170 WeakPolarHBondContact CG-O 3.49Å; N167-G170 PolarHBondContact O-N 2.86Å; N167-G170 PolarHBondContact OD1-N 2.82Å; V168-G170 VanDerWaalsContact C-N 3.35Å
171	E	94.4	Very high	92.4	Very high	63 Å²	63	42.8 Å²	42.8	29%	0.294	23%	0.233	S	C	.	.			trans	-80.3	141.6	174.6	-65.4	177.9	158.8	0	0	110.9	R115 M166 N167 I169	R115-E171 WeakPolarHBondContact CD-OE1 3.4Å; R115-E171 IonicContact CZ-OE1 3.71Å; R115-E171 IonicContact NE-OE1 3.38Å; R115-E171 IonicContact NH1-OE1 3.74Å; R115-E171 PolarHBondContact NH1-OE1 3.35Å; M166-E171 CarbonylContact C-O 3.59Å; M166-E171 VanDerWaalsContact CA-O 3.22Å; M166-E171 WeakPolarHBondContact CA-O 3.16Å; N167-E171 PolarHBondContact N-O 3.44Å; N167-E171 PolarHBondContact OD1-N 3.34Å; N167-E171 PolarHBondContact OD1-O 3.14Å; I169-E171 HydrophobicContact CD1-CG 4.03Å; I169-E171 WeakPolarHBondContact CD1-OE2 3.43Å; I169-E171 HydrophobicContact CG1-CG 4.04Å
172	P	94.8	Very high	92	Very high	39 Å²	39	50.2 Å²	50.2	25%	0.253	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-70.9	132.9	177.7	26.9	-30.7	0	0	0	111.9	R164 I165 G177 I179	R164-P172 VanDerWaalsContact NH2-CB 3.34Å; I165-P172 VanDerWaalsContact O-CA 3.3Å; I165-P172 WeakPolarHBondContact O-CA 3.48Å; P172-G177 WeakPolarHBondContact CG-O 3.43Å; P172-I179 HydrophobicContact CB-CD1 4.24Å; P172-I179 HydrophobicContact CB-CG1 4.08Å; P172-I179 HydrophobicContact CG-CG1 4.33Å
173	I	92.8	Very high	92	Very high	70 Å²	70	55.6 Å²	55.6	36%	0.359	30%	0.297	S	S	.	.			trans	-116.9	8.8	177.8	61.1	171.4	0	0	0	113	I165 N167	I165-I173 HydrophobicContact CB-CG1 4.06Å; I165-I173 HydrophobicContact CG2-CD1 3.75Å; I165-I173 HydrophobicContact CG2-CG1 3.51Å; I165-I173 PolarHBondContact O-N 3.18Å; N167-I173 HydrophobicContact CB-CG2 3.95Å
174	D	90.9	Very high	92.2	Very high	17 Å²	17	60.3 Å²	60.3	9%	0.091	32%	0.318	C	S	.	.	S	Bend	trans	-89.7	2.4	-179.6	55.7	19.1	0	0	0	114.6	R164 I165 K176	R164-D174 WeakPolarHBondContact CA-OD2 3.44Å; R164-D174 IonicContact CZ-OD1 2.96Å; R164-D174 IonicContact CZ-OD2 3.73Å; R164-D174 IonicContact NE-OD1 3.82Å; R164-D174 IonicContact NE-OD2 2.87Å; R164-D174 PolarHBondContact NE-OD2 3.48Å; R164-D174 IonicContact NH2-OD1 3.3Å; R164-D174 PolarHBondContact NH2-OD1 3.06Å; R164-D174 IonicContact NH2-OD2 2.69Å; R164-D174 PolarHBondContact NH2-OD2 2.97Å; I165-D174 HydrophobicContact CB-CB 3.95Å; I165-D174 HydrophobicContact CD1-CB 4.05Å; I165-D174 HydrophobicContact CG1-CB 4.05Å; I165-D174 PolarHBondContact N-OD2 3.34Å; D174-K176 HydrophobicContact CB-CG 4.16Å; D174-K176 WeakPolarHBondContact O-CG 3.42Å; D174-K176 PolarHBondContact O-N 3.04Å; D174-K176 VanDerWaalsContact O-N 3.12Å; D174-K176 WeakPolarHBondContact OD1-CB 3.45Å; D174-K176 PolarHBondContact OD1-N 3.1Å
175	E	88.8	Confident	92.2	Very high	183 Å²	183	61.9 Å²	61.9	86%	0.855	33%	0.327	S	S	*	.	S	Bend	trans	55.9	23.8	-175.6	-54.9	-177.9	166.3	0	0	113.5
176	K	88.4	Confident	92.3	Very high	127 Å²	127	63.1 Å²	63.1	55%	0.552	34%	0.336	S	S	*	.	S	Bend	trans	-98	19.8	178.8	-58.3	-53.6	-179	-170.9	0	114	D174	D174-K176 HydrophobicContact CB-CG 4.16Å; D174-K176 WeakPolarHBondContact O-CG 3.42Å; D174-K176 PolarHBondContact O-N 3.04Å; D174-K176 VanDerWaalsContact O-N 3.12Å; D174-K176 WeakPolarHBondContact OD1-CB 3.45Å; D174-K176 PolarHBondContact OD1-N 3.1Å
177	G	89.6	Confident	92.3	Very high	44 Å²	44	63.1 Å²	63.1	45%	0.454	34%	0.336	S	S	.	.			trans	84.6	-169	-177.5	0	0	0	0	0	112.7	R164 P172	R164-G177 PolarHBondContact NH2-O 3.4Å; P172-G177 WeakPolarHBondContact CG-O 3.43Å
178	D	91.3	Very high	92.4	Very high	108 Å²	108	64 Å²	64	58%	0.578	34%	0.339	S	S	*	.			trans	-79.5	155.7	-173	-58.4	-36.2	0	0	0	112.8	R164 T180	R164-D178 PolarHBondContact NH1-O 3.02Å; R164-D178 VanDerWaalsContact NH1-O 3.16Å; D178-T180 PolarHBondContact O-N 3.21Å
179	I	91	Very high	92.3	Very high	20 Å²	20	67.4 Å²	67.4	10%	0.103	35%	0.352	C	S	.	.			trans	-85.4	106.3	169.9	-60.3	174.6	0	0	0	107.5	P156 A160 T161 R164 M166 P172 T181	P156-I179 HydrophobicContact CB-CG2 4.06Å; P156-I179 HydrophobicContact CG-CD1 4.22Å; P156-I179 HydrophobicContact CG-CG2 4.33Å; A160-I179 HydrophobicContact CB-CG2 3.9Å; T161-I179 HydrophobicContact CG2-CG2 4.48Å; R164-I179 HydrophobicContact CB-CD1 4.23Å; R164-I179 HydrophobicContact CB-CG1 4.47Å; R164-I179 HydrophobicContact CG-CG1 4.42Å; M166-I179 HydrophobicContact CB-CD1 4.35Å; P172-I179 HydrophobicContact CB-CD1 4.24Å; P172-I179 HydrophobicContact CB-CG1 4.08Å; P172-I179 HydrophobicContact CG-CG1 4.33Å; I179-T181 HydrophobicContact CG2-CG2 4.38Å; I179-T181 PolarHBondContact O-N 3.36Å
180	T	87.2	Confident	92.3	Very high	127 Å²	127	74.8 Å²	74.8	78%	0.779	39%	0.386	S	S	*	.			trans	-86.5	94.8	-178.3	46.3	0	0	0	0	110.8	D178	D178-T180 PolarHBondContact O-N 3.21Å
181	T	88.4	Confident	92.3	Very high	25 Å²	25	76.4 Å²	76.4	15%	0.153	40%	0.399	C	S	.	.			trans	-138.3	152.7	175.3	-173.2	0	0	0	0	111.3	P156 V157 I179 H183 F184	P156-T181 HydrophobicContact CB-CG2 3.35Å; V157-T181 PolarHBondContact O-OG1 3.29Å; V157-T181 VanDerWaalsContact O-OG1 3.1Å; I179-T181 HydrophobicContact CG2-CG2 4.38Å; I179-T181 PolarHBondContact O-N 3.36Å; T181-H183 WeakPolarHBondContact CG2-O 3.42Å; T181-H183 PolarHBondContact OG1-N 3.33Å; T181-H183 VanDerWaalsContact OG1-N 3.1Å; T181-F184 HydrophobicContact CG2-CE2 4.18Å; T181-F184 HydrophobicContact CG2-CZ 4.13Å; T181-F184 VanDerWaalsContact O-CE2 3.31Å; T181-F184 WeakPolarHBondContact O-CE2 3.48Å
182	N	87.2	Confident	92.3	Very high	155 Å²	155	74.1 Å²	74.1	83%	0.829	39%	0.389	S	S	*	.	S	Bend	trans	-96.8	-9.5	170.3	-66.2	-40.4	0	0	0	112.1
183	H	92.6	Very high	92.3	Very high	114 Å²	114	74.7 Å²	74.7	53%	0.528	40%	0.397	S	S	.	.			trans	-98.9	115.9	-176.7	-59.5	-71.6	0	0	0	110.1	V157 T181	V157-H183 HydrophobicContact CG2-CB 3.77Å; V157-H183 WeakPolarHBondContact CG2-O 3.19Å; V157-H183 PolarHBondContact N-O 3.03Å; T181-H183 WeakPolarHBondContact CG2-O 3.42Å; T181-H183 PolarHBondContact OG1-N 3.33Å; T181-H183 VanDerWaalsContact OG1-N 3.1Å
184	F	94.9	Very high	92.2	Very high	100 Å²	100	80.2 Å²	80.2	44%	0.439	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	139.2	174.6	-69.5	-94.8	0	0	0	108.6	V155 P156 T181	V155-F184 VanDerWaalsContact O-CA 3.3Å; V155-F184 WeakPolarHBondContact O-CA 3.31Å; P156-F184 HydrophobicContact CB-CD1 4.32Å; P156-F184 HydrophobicContact CB-CE1 3.9Å; P156-F184 HydrophobicContact CB-CZ 4.41Å; T181-F184 HydrophobicContact CG2-CE2 4.18Å; T181-F184 HydrophobicContact CG2-CZ 4.13Å; T181-F184 VanDerWaalsContact O-CE2 3.31Å; T181-F184 WeakPolarHBondContact O-CE2 3.48Å
185	L	95.8	Very high	92.4	Very high	42 Å²	42	84.6 Å²	84.6	22%	0.22	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	145.3	176.4	-70.8	177.3	0	0	0	110.2	T154 V155 V157 T311 H315	T154-L185 CarbonylContact C-O 3.28Å; T154-L185 VanDerWaalsContact CA-O 3.32Å; T154-L185 WeakPolarHBondContact CA-O 3.46Å; V155-L185 PolarHBondContact N-O 3.12Å; V155-L185 PolarHBondContact O-N 2.9Å; V155-L185 VanDerWaalsContact O-N 3.07Å; V157-L185 HydrophobicContact CB-CD1 4.46Å; V157-L185 HydrophobicContact CG1-CB 4.11Å; V157-L185 HydrophobicContact CG1-CD1 4.15Å; V157-L185 HydrophobicContact CG1-CG 4.3Å; V157-L185 HydrophobicContact CG2-CB 4.41Å; V157-L185 HydrophobicContact CG2-CD1 3.86Å; V157-L185 HydrophobicContact CG2-CG 3.81Å; L185-T311 HydrophobicContact CB-CG2 3.57Å; L185-T311 HydrophobicContact CD1-CG2 4.39Å; L185-H315 HydrophobicContact CD1-CB 3.97Å
186	P	96.8	Very high	92.4	Very high	43 Å²	43	80.9 Å²	80.9	28%	0.279	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	144.2	172.9	29.8	-34	0	0	0	110.5	P152 I153 H188 R189 T311	P152-P186 HydrophobicContact CB-CB 4.18Å; P152-P186 HydrophobicContact CG-CB 4.39Å; I153-P186 WeakPolarHBondContact O-CA 3.48Å; P186-H188 VanDerWaalsContact C-N 3.31Å; P186-R189 HydrophobicContact CG-CG 4.13Å; P186-R189 WeakPolarHBondContact O-CD 3.29Å; P186-R189 WeakPolarHBondContact O-CG 3.11Å; P186-T311 WeakPolarHBondContact O-CG2 3.26Å
187	I	96.1	Very high	92.6	Very high	0 Å²	0	77.2 Å²	77.2	0%	0	41%	0.414	C	S	.	.	S	Bend	trans	-71.1	-28.5	178.5	65.8	174	0	0	0	112.9	I153 V155 R304 L307 T311 R368	I153-I187 HydrophobicContact CB-CD1 3.77Å; I153-I187 HydrophobicContact CB-CG1 4.03Å; I153-I187 HydrophobicContact CD1-CD1 4.03Å; I153-I187 HydrophobicContact CG1-CD1 4.4Å; I153-I187 HydrophobicContact CG2-CD1 4.1Å; I153-I187 HydrophobicContact CG2-CG2 4.29Å; I153-I187 PolarHBondContact O-N 3.32Å; V155-I187 HydrophobicContact CB-CG2 4.44Å; V155-I187 HydrophobicContact CG1-CG2 3.62Å; V155-I187 HydrophobicContact CG2-CG2 3.99Å; I187-R304 HydrophobicContact CD1-CB 4.2Å; I187-R304 HydrophobicContact CD1-CG 4.45Å; I187-L307 HydrophobicContact CB-CB 4.35Å; I187-T311 WeakPolarHBondContact CA-OG1 3.27Å; I187-T311 PolarHBondContact O-OG1 3.26Å; I187-R368 PolarHBondContact O-NH1 3.31Å; I187-R368 PolarHBondContact O-NH2 2.83Å
188	H	95.5	Very high	92.5	Very high	41 Å²	41	77.2 Å²	77.2	19%	0.19	41%	0.409	C	S	.	.			trans	-91.4	105.9	176.6	-63.8	-62.3	0	0	0	109.1	L104 E119 P186	L104-H188 HydrophobicContact CD1-CB 4.01Å; E119-H188 IonicContact OE1-NE2 2.81Å; E119-H188 IonicContact OE2-CD2 3.31Å; E119-H188 IonicContact OE2-CE1 3.01Å; E119-H188 IonicContact OE2-NE2 3.34Å; E119-H188 PolarHBondContact OE2-NE2 3.4Å; P186-H188 VanDerWaalsContact C-N 3.31Å
189	R	93.9	Very high	92.3	Very high	75 Å²	75	78.7 Å²	78.7	28%	0.283	42%	0.422	S	S	.	.			trans	-133.5	151.2	178.6	-66.8	179.2	63.9	-155.5	0.3	109.3	P186 E314 D318 R368	P186-R189 HydrophobicContact CG-CG 4.13Å; P186-R189 WeakPolarHBondContact O-CD 3.29Å; P186-R189 WeakPolarHBondContact O-CG 3.11Å; R189-E314 WeakPolarHBondContact CD-OE2 3.34Å; R189-E314 IonicContact CZ-OE2 2.71Å; R189-E314 IonicContact NE-OE2 3.94Å; R189-E314 IonicContact NH1-OE2 3.6Å; R189-E314 PolarHBondContact NH1-OE2 2.62Å; R189-D318 IonicContact CZ-OD2 2.73Å; R189-D318 IonicContact NH1-OD2 3.62Å; R189-D318 IonicContact NH2-OD2 3.43Å; R189-D318 PolarHBondContact NH2-OD2 3.43Å; R189-R368 WeakPolarHBondContact O-CD 3.3Å
190	E	94.3	Very high	92.1	Very high	172 Å²	172	84.1 Å²	84.1	80%	0.804	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-71.8	152.9	171.8	-65.7	-60.8	156	0	0	111
191	A	94.1	Very high	92	Very high	40 Å²	40	83.6 Å²	83.6	33%	0.331	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-65.2	152.6	171.5	0	0	0	0	0	111.1	A193 E367 R368	A191-A193 PolarHBondContact O-N 3.37Å; A191-E367 HydrophobicContact CB-CB 4.18Å; A191-R368 HydrophobicContact CB-CG 4.12Å
192	P	94.2	Very high	92	Very high	14 Å²	14	86 Å²	86	9%	0.091	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-56	137	175.3	-25.8	35.6	0	0	0	111.9	Q197 T370 T372	P192-Q197 HydrophobicContact CB-CG 4.39Å; P192-Q197 PolarHBondContact O-NE2 2.91Å; P192-T370 HydrophobicContact CB-CG2 4.23Å; P192-T370 HydrophobicContact CG-CG2 3.74Å; P192-T372 HydrophobicContact CB-CG2 3.84Å; P192-T372 HydrophobicContact CG-CG2 3.85Å
193	A	93.7	Very high	92.3	Very high	52 Å²	52	80.7 Å²	80.7	43%	0.43	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-63	149.4	179.3	0	0	0	0	0	111.2	A191 V195 E196 Q197	A191-A193 PolarHBondContact O-N 3.37Å; A193-V195 HydrophobicContact CB-CG2 4.07Å; A193-V195 PolarHBondContact O-N 2.98Å; A193-E196 HydrophobicContact CB-CG 4.48Å; A193-E196 WeakPolarHBondContact O-CA 3.35Å; A193-E196 WeakPolarHBondContact O-CB 3.35Å; A193-E196 PolarHBondContact O-N 3.23Å; A193-Q197 PolarHBondContact O-N 3.43Å
194	F	92.4	Very high	92.3	Very high	185 Å²	185	75.9 Å²	75.9	81%	0.811	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-30	-179.8	-67.7	-66.9	0	0	0	114	E196 Q197	F194-E196 VanDerWaalsContact C-N 3.28Å; F194-E196 PolarHBondContact O-N 3.04Å; F194-Q197 PolarHBondContact O-N 3.48Å
195	V	93.8	Very high	92.2	Very high	109 Å²	109	72.8 Å²	72.8	66%	0.661	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-19.2	177.4	-61.9	0	0	0	0	113.8	A193 K373	A193-V195 HydrophobicContact CB-CG2 4.07Å; A193-V195 PolarHBondContact O-N 2.98Å; V195-K373 WeakPolarHBondContact O-CE 3.41Å; V195-K373 PolarHBondContact O-NZ 3.2Å
196	E	90.1	Very high	92	Very high	105 Å²	105	70.8 Å²	70.8	49%	0.491	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-17.5	178.1	-59.9	-172.3	151.5	0	0	112.4	A193 F194 T372 K373	A193-E196 HydrophobicContact CB-CG 4.48Å; A193-E196 WeakPolarHBondContact O-CA 3.35Å; A193-E196 WeakPolarHBondContact O-CB 3.35Å; A193-E196 PolarHBondContact O-N 3.23Å; F194-E196 VanDerWaalsContact C-N 3.28Å; F194-E196 PolarHBondContact O-N 3.04Å; E196-T372 CarbonylContact O-C 3.49Å; E196-T372 WeakPolarHBondContact O-CA 3.12Å; E196-K373 PolarHBondContact O-N 3.27Å
197	Q	91	Very high	91.8	Very high	51 Å²	51	68.8 Å²	68.8	24%	0.238	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-72.7	143.5	179.1	-64.7	-175.5	18.1	0	0	111.2	P192 A193 F194 T370 T371	P192-Q197 HydrophobicContact CB-CG 4.39Å; P192-Q197 PolarHBondContact O-NE2 2.91Å; A193-Q197 PolarHBondContact O-N 3.43Å; F194-Q197 PolarHBondContact O-N 3.48Å; Q197-T370 HydrophobicContact CG-CG2 4.28Å; Q197-T371 WeakPolarHBondContact CA-O 3.46Å
198	A	88.8	Confident	91.7	Very high	43 Å²	43	68.8 Å²	68.8	36%	0.355	36%	0.36	S	S	.	.			trans	-82.4	140.7	174.7	0	0	0	0	0	110.8	T371	A198-T371 HydrophobicContact CB-CG2 3.54Å; A198-T371 PolarHBondContact N-O 2.8Å
199	T	86.6	Confident	91.7	Very high	139 Å²	139	66.9 Å²	66.9	85%	0.853	35%	0.352	S	S	*	.			trans	-93.5	-11.3	178.9	53.4	0	0	0	0	113.4
200	E	86	Confident	91.7	Very high	134 Å²	134	63.4 Å²	63.4	63%	0.626	34%	0.339	S	S	*	.			trans	-80.5	129.9	-176.8	-66.4	-176.6	-172.8	0	0	111.4	Q202	E200-Q202 HydrophobicContact CB-CG 4.42Å; E200-Q202 PolarHBondContact OE2-NE2 2.91Å
201	Q	85.4	Confident	91.7	Very high	116 Å²	116	55.3 Å²	55.3	54%	0.542	30%	0.301	S	S	.	.			trans	-88.3	112.3	170.4	-67.4	-178.3	-20.6	0	0	108.9	M430	Q201-M430 HydrophobicContact CB-SD 4.42Å
202	Q	90	Very high	91.8	Very high	75 Å²	75	53.5 Å²	53.5	35%	0.35	29%	0.286	S	S	.	.			trans	-123	145.2	177.5	-64	-178.8	-4.3	0	0	109.7	E200 R219	E200-Q202 HydrophobicContact CB-CG 4.42Å; E200-Q202 PolarHBondContact OE2-NE2 2.91Å; Q202-R219 HydrophobicContact CB-CB 4.25Å; Q202-R219 WeakPolarHBondContact O-CB 3.44Å; Q202-R219 PolarHBondContact O-N 2.79Å
203	I	92.5	Very high	91.8	Very high	44 Å²	44	52.9 Å²	52.9	23%	0.226	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	137.5	176.2	-51.1	156.6	0	0	0	108.7	P216 Y217 V435 L436	I203-P216 HydrophobicContact CG2-CB 3.76Å; I203-Y217 CarbonylContact C-O 3.55Å; I203-Y217 WeakPolarHBondContact CA-O 3.42Å; I203-Y217 WeakPolarHBondContact CG2-O 3.43Å; I203-V435 HydrophobicContact CG1-CG1 4.37Å; I203-L436 HydrophobicContact CD1-CD2 3.17Å; I203-L436 HydrophobicContact CG1-CD2 3.87Å
204	L	92	Very high	91.9	Very high	13 Å²	13	50.4 Å²	50.4	7%	0.068	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	104.8	165.2	179.4	68.1	0	0	0	109.1	T206 Y217 V244 L325 T378	L204-T206 PolarHBondContact O-N 3.28Å; L204-Y217 PolarHBondContact N-O 2.89Å; L204-V244 HydrophobicContact CD1-CG1 4.42Å; L204-V244 HydrophobicContact CD2-CG2 4.35Å; L204-L325 HydrophobicContact CD2-CD2 3.77Å; L204-T378 HydrophobicContact CD2-CG2 3.93Å
205	V	92.9	Very high	92	Very high	36 Å²	36	41.7 Å²	41.7	22%	0.218	22%	0.223	C	C	.	.			trans	-71.4	115.8	175.8	-177.3	0	0	0	0	109.3	D212 H248 L507	V205-D212 WeakPolarHBondContact CG1-OD2 3.42Å; V205-H248 PolarHBondContact O-NE2 3.46Å; V205-L507 HydrophobicContact CG1-CB 4.32Å; V205-L507 HydrophobicContact CG2-CD2 4.42Å
206	T	92.3	Very high	92	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.192	C	C	.	.			trans	-89.4	-20.1	-176.9	65.9	0	0	0	0	113	L204 I208 V211 D212 Y217 L240 N243	L204-T206 PolarHBondContact O-N 3.28Å; T206-I208 PolarHBondContact OG1-N 2.85Å; T206-V211 HydrophobicContact CG2-CG1 4.03Å; T206-D212 WeakPolarHBondContact CB-OD1 3.36Å; T206-D212 PolarHBondContact N-OD1 3.01Å; T206-D212 PolarHBondContact N-OD2 3.37Å; T206-D212 VanDerWaalsContact OG1-CG 3.3Å; T206-D212 PolarHBondContact OG1-OD1 3Å; T206-Y217 HydrophobicContact CG2-CD2 3.66Å; T206-Y217 HydrophobicContact CG2-CE2 4.12Å; T206-Y217 HydrophobicContact CG2-CG 4.31Å; T206-L240 HydrophobicContact CG2-CD2 3.66Å; T206-N243 WeakPolarHBondContact O-CB 3.39Å; T206-N243 PolarHBondContact O-ND2 3.31Å
207	G	92.4	Very high	92.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.169	C	C	.	.	S	Bend	trans	78	5.9	-171.6	0	0	0	0	0	113.5	D212 Q489 Y504 V505	G207-D212 WeakPolarHBondContact CA-OD2 3.41Å; G207-D212 PolarHBondContact N-OD2 3.09Å; G207-Q489 PolarHBondContact O-NE2 3.15Å; G207-Q489 PolarHBondContact O-OE1 3.47Å; G207-Y504 VanDerWaalsContact CA-CE2 3.49Å; G207-V505 WeakPolarHBondContact CA-O 3.5Å; G207-V505 PolarHBondContact O-N 2.83Å
208	I	93.9	Very high	92.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.165	C	C	.	.			trans	-100.9	114.8	178.3	-58.7	177.2	0	0	0	108.5	T206 V210 V211 D212 L236 E239 L240 P419 F491	T206-I208 PolarHBondContact OG1-N 2.85Å; I208-V210 HydrophobicContact CG2-CG1 3.88Å; I208-V210 PolarHBondContact O-N 2.61Å; I208-V211 HydrophobicContact CB-CB 4.21Å; I208-V211 HydrophobicContact CB-CG2 4.21Å; I208-V211 HydrophobicContact CG2-CB 4.32Å; I208-V211 HydrophobicContact CG2-CG2 3.94Å; I208-V211 PolarHBondContact O-N 2.89Å; I208-V211 VanDerWaalsContact O-N 3.1Å; I208-D212 PolarHBondContact N-OD2 2.91Å; I208-D212 WeakPolarHBondContact O-CB 3.35Å; I208-D212 PolarHBondContact O-N 2.72Å; I208-L236 HydrophobicContact CD1-CD1 3.6Å; I208-E239 HydrophobicContact CD1-CG 4.22Å; I208-L240 HydrophobicContact CD1-CD2 3.79Å; I208-L240 HydrophobicContact CD1-CG 4.21Å; I208-P419 HydrophobicContact CG2-CG 4.18Å; I208-F491 HydrophobicContact CD1-CE1 4.28Å; I208-F491 HydrophobicContact CD1-CZ 3.99Å; I208-F491 HydrophobicContact CG1-CE1 4.24Å; I208-F491 HydrophobicContact CG1-CZ 4.43Å; I208-F491 HydrophobicContact CG2-CE1 4.26Å; I208-F491 HydrophobicContact CG2-CZ 4.31Å
209	K	94.8	Very high	92.5	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.009	16%	0.161	C	C	.	.	H	α-helix	trans	-50.2	-51.1	-173.4	-73.5	-173.5	-71.6	-174.6	0	113.7	V211 L213 F486 S488 V505 F514 V533 G534	K209-V211 VanDerWaalsContact C-N 3.33Å; K209-V211 PolarHBondContact O-N 3.22Å; K209-L213 WeakPolarHBondContact O-CB 3.39Å; K209-L213 PolarHBondContact O-N 2.71Å; K209-F486 WeakPolarHBondContact CE-O 3.46Å; K209-F486 PolarHBondContact NZ-O 3.39Å; K209-S488 WeakPolarHBondContact CE-O 3.45Å; K209-S488 PolarHBondContact NZ-O 3.26Å; K209-V505 HydrophobicContact CD-CB 4.46Å; K209-V505 HydrophobicContact CD-CG1 4.14Å; K209-V505 HydrophobicContact CD-CG2 4.17Å; K209-V505 HydrophobicContact CG-CB 3.87Å; K209-V505 HydrophobicContact CG-CG1 3.81Å; K209-V505 HydrophobicContact CG-CG2 3.97Å; K209-F514 HydrophobicContact CB-CE2 4.31Å; K209-F514 HydrophobicContact CD-CE2 4.26Å; K209-V533 PolarHBondContact NZ-O 3.34Å; K209-G534 WeakPolarHBondContact CD-O 3.41Å; K209-G534 WeakPolarHBondContact CE-O 3.5Å; K209-G534 PolarHBondContact NZ-O 3.17Å
210	V	94.3	Very high	92.8	Very high	2 Å²	2	26 Å²	26	1%	0.012	12%	0.124	C	C	.	.	H	α-helix	trans	-65.4	-37.2	-176.4	63	0	0	0	0	112.4	I208 L214 P419 V421 L487	I208-V210 HydrophobicContact CG2-CG1 3.88Å; I208-V210 PolarHBondContact O-N 2.61Å; V210-L214 HydrophobicContact CG2-CD1 4.26Å; V210-L214 WeakPolarHBondContact O-CB 3.39Å; V210-L214 PolarHBondContact O-N 2.95Å; V210-L214 VanDerWaalsContact O-N 3.16Å; V210-P419 HydrophobicContact CG1-CG 3.72Å; V210-V421 HydrophobicContact CB-CB 4.48Å; V210-V421 HydrophobicContact CG1-CB 3.83Å; V210-V421 HydrophobicContact CG1-CG1 4.24Å; V210-V421 HydrophobicContact CG1-CG2 3.86Å; V210-V421 HydrophobicContact CG2-CB 3.8Å; V210-V421 HydrophobicContact CG2-CG1 3.65Å; V210-L487 HydrophobicContact CB-CB 4.47Å; V210-L487 HydrophobicContact CB-CD2 3.95Å; V210-L487 HydrophobicContact CG2-CD2 4.07Å
211	V	94.7	Very high	93.1	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.006	9%	0.094	C	C	.	.	H	α-helix	trans	-73.1	-54.5	179.4	176.2	0	0	0	0	109.5	T206 I208 K209 L213 A215 P216 Y217	T206-V211 HydrophobicContact CG2-CG1 4.03Å; I208-V211 HydrophobicContact CB-CB 4.21Å; I208-V211 HydrophobicContact CB-CG2 4.21Å; I208-V211 HydrophobicContact CG2-CB 4.32Å; I208-V211 HydrophobicContact CG2-CG2 3.94Å; I208-V211 PolarHBondContact O-N 2.89Å; I208-V211 VanDerWaalsContact O-N 3.1Å; K209-V211 VanDerWaalsContact C-N 3.33Å; K209-V211 PolarHBondContact O-N 3.22Å; V211-L213 VanDerWaalsContact C-N 3.31Å; V211-L213 PolarHBondContact O-N 3.44Å; V211-A215 CarbonylContact O-C 3.22Å; V211-A215 WeakPolarHBondContact O-CA 3.45Å; V211-A215 PolarHBondContact O-N 3.32Å; V211-P216 WeakPolarHBondContact O-CA 2.95Å; V211-Y217 HydrophobicContact CG1-CD1 3.69Å; V211-Y217 HydrophobicContact CG1-CD2 4.11Å; V211-Y217 HydrophobicContact CG1-CE1 3.43Å; V211-Y217 VanDerWaalsContact CG1-CE1 3.43Å; V211-Y217 HydrophobicContact CG1-CE2 3.87Å; V211-Y217 HydrophobicContact CG1-CG 4.03Å
212	D	95.2	Very high	93.6	Very high	3 Å²	3	15 Å²	15	2%	0.016	7%	0.073	C	C	.	.	H	α-helix	trans	-64.5	-34.8	-175.3	-70.2	-11.9	0	0	0	112.3	V205 T206 G207 I208 H440 L507	V205-D212 WeakPolarHBondContact CG1-OD2 3.42Å; T206-D212 WeakPolarHBondContact CB-OD1 3.36Å; T206-D212 PolarHBondContact N-OD1 3.01Å; T206-D212 PolarHBondContact N-OD2 3.37Å; T206-D212 VanDerWaalsContact OG1-CG 3.3Å; T206-D212 PolarHBondContact OG1-OD1 3Å; G207-D212 WeakPolarHBondContact CA-OD2 3.41Å; G207-D212 PolarHBondContact N-OD2 3.09Å; I208-D212 PolarHBondContact N-OD2 2.91Å; I208-D212 WeakPolarHBondContact O-CB 3.35Å; I208-D212 PolarHBondContact O-N 2.72Å; D212-H440 PolarHBondContact O-CE1 2.87Å; D212-H440 PolarHBondContact O-NE2 3.1Å; D212-H440 VanDerWaalsContact O-NE2 3.09Å; D212-L507 HydrophobicContact CB-CD1 4.05Å
213	L	95.2	Very high	93.9	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-76.6	-52.2	178.2	-174.2	72.7	0	0	0	112.7	K209 V211 H440 T443 A444 V447 V511 F514	K209-L213 WeakPolarHBondContact O-CB 3.39Å; K209-L213 PolarHBondContact O-N 2.71Å; V211-L213 VanDerWaalsContact C-N 3.31Å; V211-L213 PolarHBondContact O-N 3.44Å; L213-H440 PolarHBondContact O-NE2 3.47Å; L213-T443 HydrophobicContact CD1-CG2 4.15Å; L213-A444 HydrophobicContact CG-CB 4.42Å; L213-A444 WeakPolarHBondContact O-CB 3.42Å; L213-V447 HydrophobicContact CD2-CG2 4.19Å; L213-V511 HydrophobicContact CD1-CG2 4.09Å; L213-F514 HydrophobicContact CD2-CB 4.16Å; L213-F514 HydrophobicContact CD2-CD1 4.01Å; L213-F514 HydrophobicContact CD2-CD2 3.49Å; L213-F514 VanDerWaalsContact CD2-CD2 3.49Å; L213-F514 HydrophobicContact CD2-CE1 4.28Å; L213-F514 HydrophobicContact CD2-CE2 3.82Å; L213-F514 HydrophobicContact CD2-CG 3.61Å; L213-F514 HydrophobicContact CD2-CZ 4.21Å
214	L	94.7	Very high	94	Very high	1 Å²	1	9.4 Å²	9.4	1%	0.005	5%	0.046	C	C	.	.	H	α-helix	trans	-103.8	-33.6	-164.5	-58.5	179.2	0	0	0	114	V210 P216 P423 A444 V447 Q448 L487	V210-L214 HydrophobicContact CG2-CD1 4.26Å; V210-L214 WeakPolarHBondContact O-CB 3.39Å; V210-L214 PolarHBondContact O-N 2.95Å; V210-L214 VanDerWaalsContact O-N 3.16Å; L214-P216 VanDerWaalsContact C-CD 3.43Å; L214-P423 HydrophobicContact CD1-CB 3.23Å; L214-A444 HydrophobicContact CD2-CB 4.15Å; L214-V447 HydrophobicContact CD1-CG1 4.43Å; L214-V447 HydrophobicContact CD2-CB 4.32Å; L214-V447 HydrophobicContact CD2-CG1 4.01Å; L214-Q448 HydrophobicContact CD2-CG 4.18Å; L214-L487 HydrophobicContact CD1-CD1 4.47Å; L214-L487 HydrophobicContact CD1-CD2 4.27Å
215	A	94.8	Very high	94	Very high	1 Å²	1	8.8 Å²	8.8	1%	0.008	4%	0.042	C	C	.	.	S	Bend	trans	-132.4	59.5	-178.6	0	0	0	0	0	111.1	V211 Y217	V211-A215 CarbonylContact O-C 3.22Å; V211-A215 WeakPolarHBondContact O-CA 3.45Å; V211-A215 PolarHBondContact O-N 3.32Å; A215-Y217 VanDerWaalsContact O-CD1 3.22Å; A215-Y217 WeakPolarHBondContact O-CD1 3.5Å; A215-Y217 WeakPolarHBondContact O-CE1 3.27Å; A215-Y217 PolarHBondContact O-N 3.33Å
216	P	95.3	Very high	93.8	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.036	C	C	.	.	P	Polyproline II helix	trans	-59.7	134.6	-173.6	18.9	-29.5	0	0	0	111.3	I203 V211 L214 S428 M430 L436	I203-P216 HydrophobicContact CG2-CB 3.76Å; V211-P216 WeakPolarHBondContact O-CA 2.95Å; L214-P216 VanDerWaalsContact C-CD 3.43Å; P216-S428 WeakPolarHBondContact O-CB 3.33Å; P216-S428 PolarHBondContact O-OG 3.07Å; P216-M430 HydrophobicContact CB-CB 4.43Å; P216-M430 HydrophobicContact CG-CB 4.04Å; P216-L436 HydrophobicContact CB-CD2 4.45Å; P216-L436 HydrophobicContact CG-CD1 4.11Å; P216-L436 HydrophobicContact CG-CD2 4.03Å
217	Y	95	Very high	93.5	Very high	3 Å²	3	9.1 Å²	9.1	1%	0.012	5%	0.047	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	135.7	-178.3	-68.9	-5	0	0	0	110.8	I203 L204 T206 V211 A215 I223 L240 V380 A404 T406	I203-Y217 CarbonylContact C-O 3.55Å; I203-Y217 WeakPolarHBondContact CA-O 3.42Å; I203-Y217 WeakPolarHBondContact CG2-O 3.43Å; L204-Y217 PolarHBondContact N-O 2.89Å; T206-Y217 HydrophobicContact CG2-CD2 3.66Å; T206-Y217 HydrophobicContact CG2-CE2 4.12Å; T206-Y217 HydrophobicContact CG2-CG 4.31Å; V211-Y217 HydrophobicContact CG1-CD1 3.69Å; V211-Y217 HydrophobicContact CG1-CD2 4.11Å; V211-Y217 HydrophobicContact CG1-CE1 3.43Å; V211-Y217 VanDerWaalsContact CG1-CE1 3.43Å; V211-Y217 HydrophobicContact CG1-CE2 3.87Å; V211-Y217 HydrophobicContact CG1-CG 4.03Å; A215-Y217 VanDerWaalsContact O-CD1 3.22Å; A215-Y217 WeakPolarHBondContact O-CD1 3.5Å; A215-Y217 WeakPolarHBondContact O-CE1 3.27Å; A215-Y217 PolarHBondContact O-N 3.33Å; Y217-I223 HydrophobicContact CD1-CG1 3.66Å; Y217-I223 HydrophobicContact CD1-CG2 4.12Å; Y217-I223 HydrophobicContact CD2-CD1 4.21Å; Y217-I223 HydrophobicContact CD2-CG1 4.03Å; Y217-I223 HydrophobicContact CE1-CB 4.37Å; Y217-I223 HydrophobicContact CE1-CG1 3.93Å; Y217-I223 HydrophobicContact CE1-CG2 3.51Å; Y217-I223 HydrophobicContact CE2-CG1 4.28Å; Y217-I223 HydrophobicContact CE2-CG2 4.25Å; Y217-I223 HydrophobicContact CG-CD1 4.07Å; Y217-I223 HydrophobicContact CG-CG1 3.71Å; Y217-L240 HydrophobicContact CE2-CD1 4.07Å; Y217-L240 HydrophobicContact CE2-CD2 4.13Å; Y217-V380 HydrophobicContact CE2-CG2 4.42Å; Y217-A404 HydrophobicContact CD1-CB 4.29Å; Y217-T406 WeakPolarHBondContact CE1-OG1 3.35Å; Y217-T406 PolarHBondContact OH-OG1 3.42Å
218	Q	93.3	Very high	92.9	Very high	34 Å²	34	10.9 Å²	10.9	16%	0.159	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	134.3	172.8	-175	176.5	-8.7	0	0	109.8	G220 G221 T378 D403 M430	Q218-G220 PolarHBondContact O-N 3.33Å; Q218-G221 WeakPolarHBondContact O-CA 3.43Å; Q218-G221 PolarHBondContact O-N 3.04Å; Q218-T378 WeakPolarHBondContact O-CG2 3.17Å; Q218-D403 HydrophobicContact CB-CB 4.48Å; Q218-M430 HydrophobicContact CB-CE 4.2Å; Q218-M430 HydrophobicContact CB-CG 3.73Å; Q218-M430 HydrophobicContact CB-SD 3.79Å; Q218-M430 HydrophobicContact CG-CE 4.04Å; Q218-M430 HydrophobicContact CG-CG 4.33Å; Q218-M430 HydrophobicContact CG-SD 3.69Å
219	R	91.6	Very high	92.2	Very high	73 Å²	73	15.1 Å²	15.1	28%	0.275	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	122.9	170.4	-176.7	179.7	177.5	-167.1	1.3	109.8	Q202 G221 D323 T371 S376	Q202-R219 HydrophobicContact CB-CB 4.25Å; Q202-R219 WeakPolarHBondContact O-CB 3.44Å; Q202-R219 PolarHBondContact O-N 2.79Å; R219-G221 PolarHBondContact O-N 2.78Å; R219-D323 IonicContact CZ-OD1 3.16Å; R219-D323 IonicContact CZ-OD2 3.53Å; R219-D323 VanDerWaalsContact CZ-OD2 3.27Å; R219-D323 IonicContact NE-OD1 3.49Å; R219-D323 PolarHBondContact NE-OD1 3.32Å; R219-D323 IonicContact NE-OD2 3.21Å; R219-D323 PolarHBondContact NE-OD2 2.85Å; R219-D323 IonicContact NH2-OD1 2.7Å; R219-D323 PolarHBondContact NH2-OD1 3.27Å; R219-D323 IonicContact NH2-OD2 3.01Å; R219-D323 PolarHBondContact NH2-OD2 2.92Å; R219-T371 PolarHBondContact O-OG1 2.99Å; R219-S376 WeakPolarHBondContact CG-OG 3.23Å
220	G	92.1	Very high	91.6	Very high	7 Å²	7	18.7 Å²	18.7	7%	0.072	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	11.7	-171.5	0	0	0	0	0	114.7	Q218 T371 I377 T378	Q218-G220 PolarHBondContact O-N 3.33Å; G220-T371 VanDerWaalsContact CA-OG1 3.25Å; G220-T371 WeakPolarHBondContact CA-OG1 3.43Å; G220-I377 CarbonylContact C-O 3.57Å; G220-I377 VanDerWaalsContact CA-O 3.28Å; G220-I377 WeakPolarHBondContact CA-O 3.34Å; G220-T378 PolarHBondContact N-OG1 3.26Å
221	G	92.8	Very high	91.2	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	14%	0.138	C	C	.	.			trans	-83.8	173	179.7	0	0	0	0	0	113.4	Q218 R219 S379 D403	Q218-G221 WeakPolarHBondContact O-CA 3.43Å; Q218-G221 PolarHBondContact O-N 3.04Å; R219-G221 PolarHBondContact O-N 2.78Å; G221-S379 PolarHBondContact O-N 3.39Å; G221-D403 WeakPolarHBondContact CA-OD2 3.26Å
222	K	95.5	Very high	90.9	Very high	21 Å²	21	19.7 Å²	19.7	9%	0.091	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	113.5	176.6	-58.8	133.9	-169.1	179.1	0	109.8	Q366 E367 I369 S379 H401 L402 D403 A404	K222-Q366 WeakPolarHBondContact CE-O 3.25Å; K222-Q366 PolarHBondContact NZ-O 3.48Å; K222-Q366 VanDerWaalsContact NZ-O 3.14Å; K222-E367 IonicContact NZ-OE1 3.79Å; K222-I369 WeakPolarHBondContact CE-O 3.38Å; K222-I369 HydrophobicContact CG-CB 4.35Å; K222-I369 HydrophobicContact CG-CG2 3.93Å; K222-S379 WeakPolarHBondContact CA-OG 3.33Å; K222-H401 HydrophobicContact CD-CB 4.3Å; K222-H401 WeakPolarHBondContact CD-O 3.3Å; K222-L402 HydrophobicContact CB-CD2 4.11Å; K222-L402 CarbonylContact O-C 3.59Å; K222-L402 WeakPolarHBondContact O-CA 3.18Å; K222-D403 PolarHBondContact N-OD2 2.86Å; K222-D403 PolarHBondContact O-N 2.99Å; K222-A404 PolarHBondContact O-N 2.94Å
223	I	95.6	Very high	90.5	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125	-177.9	-59.2	88.9	0	0	0	109.1	Y217 T378 S379 V380 Q381 A404	Y217-I223 HydrophobicContact CD1-CG1 3.66Å; Y217-I223 HydrophobicContact CD1-CG2 4.12Å; Y217-I223 HydrophobicContact CD2-CD1 4.21Å; Y217-I223 HydrophobicContact CD2-CG1 4.03Å; Y217-I223 HydrophobicContact CE1-CB 4.37Å; Y217-I223 HydrophobicContact CE1-CG1 3.93Å; Y217-I223 HydrophobicContact CE1-CG2 3.51Å; Y217-I223 HydrophobicContact CE2-CG1 4.28Å; Y217-I223 HydrophobicContact CE2-CG2 4.25Å; Y217-I223 HydrophobicContact CG-CD1 4.07Å; Y217-I223 HydrophobicContact CG-CG1 3.71Å; I223-T378 HydrophobicContact CD1-CG2 3.45Å; I223-T378 VanDerWaalsContact CD1-CG2 3.45Å; I223-S379 WeakPolarHBondContact CB-O 3.45Å; I223-S379 WeakPolarHBondContact CD1-O 3.44Å; I223-S379 PolarHBondContact N-O 3.43Å; I223-V380 HydrophobicContact CB-CG2 4.36Å; I223-Q381 PolarHBondContact O-N 3.29Å; I223-A404 CarbonylContact C-O 3.6Å; I223-A404 WeakPolarHBondContact CA-O 3.37Å; I223-A404 HydrophobicContact CG1-CB 4.22Å; I223-A404 HydrophobicContact CG2-CB 4.48Å
224	G	94.6	Very high	89.9	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	124.4	169.3	0	0	0	0	0	111.4	Q381 A404 T405 T406	G224-Q381 CarbonylContact C-O 3.56Å; G224-A404 PolarHBondContact N-O 3.15Å; G224-T405 CarbonylContact O-C 3.58Å; G224-T405 WeakPolarHBondContact O-CA 3.45Å; G224-T406 PolarHBondContact O-N 2.99Å
225	L	92.7	Very high	89.6	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	111.8	172.9	-175.6	65.8	0	0	0	109.8	K233 L236 I237 V380 Q381 A382 I383 T406 L408	L225-K233 HydrophobicContact CD2-CB 4.24Å; L225-K233 HydrophobicContact CD2-CD 4.48Å; L225-K233 HydrophobicContact CD2-CG 4.11Å; L225-K233 HydrophobicContact CG-CG 4.41Å; L225-L236 HydrophobicContact CD1-CD2 3.69Å; L225-I237 HydrophobicContact CD2-CD1 4.13Å; L225-I237 HydrophobicContact CD2-CG1 4.09Å; L225-V380 HydrophobicContact CB-CG1 4.18Å; L225-V380 HydrophobicContact CD2-CG1 4.44Å; L225-Q381 PolarHBondContact N-O 2.7Å; L225-A382 WeakPolarHBondContact O-CA 3.32Å; L225-I383 PolarHBondContact O-N 2.76Å; L225-T406 WeakPolarHBondContact CA-O 3.45Å; L225-T406 HydrophobicContact CD1-CG2 4.02Å; L225-L408 HydrophobicContact CD1-CD1 4.04Å; L225-L408 HydrophobicContact CD1-CG 4.14Å
226	F	89.6	Confident	89.4	Confident	20 Å²	20	26.4 Å²	26.4	9%	0.088	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	143.1	178.4	-62.5	-96.9	0	0	0	109.4	I383 V385 F399 L402 T405 T406 V407 L408	F226-I383 HydrophobicContact CD1-CB 4.08Å; F226-I383 HydrophobicContact CD1-CG2 4.19Å; F226-I383 HydrophobicContact CE1-CB 3.55Å; F226-I383 HydrophobicContact CE1-CD1 4.11Å; F226-I383 HydrophobicContact CE1-CG1 4.44Å; F226-I383 HydrophobicContact CE1-CG2 3.39Å; F226-I383 HydrophobicContact CE2-CB 4.41Å; F226-I383 HydrophobicContact CE2-CD1 3.79Å; F226-I383 HydrophobicContact CZ-CB 3.71Å; F226-I383 HydrophobicContact CZ-CD1 3.35Å; F226-I383 HydrophobicContact CZ-CG1 4.11Å; F226-I383 HydrophobicContact CZ-CG2 3.8Å; F226-V385 HydrophobicContact CD1-CG2 3.98Å; F226-V385 HydrophobicContact CE1-CG2 3.81Å; F226-F399 AromaticContact CE1-CE1 3.8Å; F226-F399 HydrophobicContact CE1-CE1 3.8Å; F226-F399 AromaticContact CE1-CZ 3.54Å; F226-F399 HydrophobicContact CE1-CZ 3.54Å; F226-F399 AromaticContact CE2-CE1 3.86Å; F226-F399 HydrophobicContact CE2-CE1 3.86Å; F226-F399 HydrophobicContact CE2-CZ 4.43Å; F226-F399 HydrophobicContact CZ-CD1 4.16Å; F226-F399 AromaticContact CZ-CE1 3.12Å; F226-F399 HydrophobicContact CZ-CE1 3.12Å; F226-F399 AromaticContact CZ-CZ 3.39Å; F226-F399 HydrophobicContact CZ-CZ 3.39Å; F226-L402 HydrophobicContact CE2-CD1 4.49Å; F226-L402 HydrophobicContact CZ-CD1 4.45Å; F226-T405 HydrophobicContact CD2-CG2 3.52Å; F226-T405 HydrophobicContact CE2-CG2 3.44Å; F226-T405 VanDerWaalsContact CE2-CG2 3.44Å; F226-T405 HydrophobicContact CZ-CG2 4.48Å; F226-T406 PolarHBondContact N-O 2.88Å; F226-V407 HydrophobicContact CB-CB 4.47Å; F226-V407 HydrophobicContact CB-CG1 4.37Å; F226-V407 HydrophobicContact CB-CG2 4.2Å; F226-V407 HydrophobicContact CD2-CG2 4.4Å; F226-L408 WeakPolarHBondContact O-CB 3.48Å; F226-L408 PolarHBondContact O-N 3.38Å
227	G	85	Confident	89.1	Confident	23 Å²	23	26.6 Å²	26.6	24%	0.237	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.9	143.7	175.9	0	0	0	0	0	113.3	K233 L408	G227-K233 WeakPolarHBondContact O-CE 3.35Å; G227-K233 PolarHBondContact O-NZ 3.49Å; G227-L408 WeakPolarHBondContact CA-O 3.24Å
228	G	79.3	Confident	88.8	Confident	37 Å²	37	26.7 Å²	26.7	38%	0.381	19%	0.187	S	C	.	.			trans	-68.9	-179	175.1	0	0	0	0	0	113.4	V231	G228-V231 WeakPolarHBondContact O-CG2 3.47Å
229	A	79.8	Confident	88.6	Confident	89 Å²	89	25 Å²	25	74%	0.736	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	141.1	170.2	0	0	0	0	0	110.6	V231	A229-V231 VanDerWaalsContact C-N 3.34Å; A229-V231 PolarHBondContact O-N 3.14Å
230	G	82.5	Confident	88.6	Confident	76 Å²	76	21.7 Å²	21.7	78%	0.784	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.6	-1.4	172.6	0	0	0	0	0	116.7	G232	G230-G232 PolarHBondContact O-N 3.43Å
231	V	86.5	Confident	88.4	Confident	2 Å²	2	21.4 Å²	21.4	1%	0.012	16%	0.164	C	C	.	.	S	Bend	trans	-80.2	2.9	-179.7	-56.7	0	0	0	0	114.5	G228 A229 K233 L408 R410	G228-V231 WeakPolarHBondContact O-CG2 3.47Å; A229-V231 VanDerWaalsContact C-N 3.34Å; A229-V231 PolarHBondContact O-N 3.14Å; V231-K233 HydrophobicContact CG2-CG 4.13Å; V231-L408 HydrophobicContact CB-CB 4.08Å; V231-L408 HydrophobicContact CG2-CB 3.46Å; V231-L408 VanDerWaalsContact CG2-CB 3.46Å; V231-L408 HydrophobicContact CG2-CD1 3.92Å; V231-L408 HydrophobicContact CG2-CG 4.35Å; V231-R410 HydrophobicContact CG1-CB 4.39Å
232	G	87.3	Confident	88	Confident	23 Å²	23	22.4 Å²	22.4	24%	0.237	17%	0.169	C	C	.	.	S	Bend	trans	91.2	22	178	0	0	0	0	0	116.2	G230 T234 V235 L236	G230-G232 PolarHBondContact O-N 3.43Å; G232-T234 PolarHBondContact O-N 3.2Å; G232-V235 PolarHBondContact O-N 2.95Å; G232-L236 PolarHBondContact O-N 3.32Å
233	K	86.8	Confident	87.6	Confident	44 Å²	44	21.4 Å²	21.4	19%	0.191	17%	0.165	C	C	.	.	H	α-helix	trans	-51.1	-53.1	175.8	-76.7	-172	-60.2	178.9	0	113.1	L225 G227 V231 V235 L236 I237 L408	L225-K233 HydrophobicContact CD2-CB 4.24Å; L225-K233 HydrophobicContact CD2-CD 4.48Å; L225-K233 HydrophobicContact CD2-CG 4.11Å; L225-K233 HydrophobicContact CG-CG 4.41Å; G227-K233 WeakPolarHBondContact O-CE 3.35Å; G227-K233 PolarHBondContact O-NZ 3.49Å; V231-K233 HydrophobicContact CG2-CG 4.13Å; K233-V235 VanDerWaalsContact C-N 3.31Å; K233-V235 PolarHBondContact O-N 2.84Å; K233-L236 PolarHBondContact O-N 2.96Å; K233-I237 WeakPolarHBondContact O-CG1 3.49Å; K233-I237 PolarHBondContact O-N 2.84Å; K233-L408 HydrophobicContact CB-CD1 4.25Å; K233-L408 HydrophobicContact CG-CD1 3.57Å
234	T	84.1	Confident	87.1	Confident	56 Å²	56	21.7 Å²	21.7	34%	0.344	17%	0.167	S	C	.	.	H	α-helix	trans	-57.3	-45	179.4	-49.1	0	0	0	0	111.4	G232 L236 I237 M238 L267	G232-T234 PolarHBondContact O-N 3.2Å; T234-L236 PolarHBondContact O-N 3.16Å; T234-I237 PolarHBondContact O-N 3.34Å; T234-M238 HydrophobicContact CG2-CE 4.01Å; T234-M238 WeakPolarHBondContact O-CG 3.22Å; T234-M238 PolarHBondContact O-N 3.06Å; T234-L267 HydrophobicContact CG2-CD1 3.59Å
235	V	87.4	Confident	86.4	Confident	43 Å²	43	22.6 Å²	22.6	26%	0.261	17%	0.174	S	C	.	.	H	α-helix	trans	-63.4	-41.7	179.4	174.8	0	0	0	0	111.2	G232 K233 M238 E239 F491 V493 A494	G232-V235 PolarHBondContact O-N 2.95Å; K233-V235 VanDerWaalsContact C-N 3.31Å; K233-V235 PolarHBondContact O-N 2.84Å; V235-M238 HydrophobicContact CG2-CE 4.43Å; V235-E239 WeakPolarHBondContact O-CB 3.5Å; V235-E239 PolarHBondContact O-N 2.65Å; V235-F491 HydrophobicContact CG1-CD2 3.77Å; V235-F491 HydrophobicContact CG1-CE2 4.34Å; V235-V493 HydrophobicContact CG1-CG2 4.22Å; V235-A494 HydrophobicContact CG1-CB 4.26Å
236	L	90.9	Very high	85.7	Confident	2 Å²	2	28.6 Å²	28.6	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-64.2	-44.8	174.7	-178	65.5	0	0	0	111.9	I208 L225 G232 K233 T234 M238 E239 L240 T406 L408 F491	I208-L236 HydrophobicContact CD1-CD1 3.6Å; L225-L236 HydrophobicContact CD1-CD2 3.69Å; G232-L236 PolarHBondContact O-N 3.32Å; K233-L236 PolarHBondContact O-N 2.96Å; T234-L236 PolarHBondContact O-N 3.16Å; L236-M238 PolarHBondContact O-N 3.33Å; L236-E239 PolarHBondContact O-N 3.35Å; L236-L240 HydrophobicContact CG-CD1 4.23Å; L236-L240 VanDerWaalsContact O-CG 3.3Å; L236-L240 WeakPolarHBondContact O-CG 3.37Å; L236-L240 PolarHBondContact O-N 3.39Å; L236-T406 HydrophobicContact CD2-CG2 4.37Å; L236-L408 HydrophobicContact CD2-CD1 4.3Å; L236-L408 HydrophobicContact CD2-CD2 4.27Å; L236-F491 HydrophobicContact CD1-CE2 4.15Å; L236-F491 HydrophobicContact CD1-CZ 4.04Å
237	I	89.3	Confident	85	Confident	5 Å²	5	30 Å²	30	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-58.4	-48.4	177.3	-73.5	168.9	0	0	0	110.8	L225 K233 T234 E239 L240 I241 F254 F327	L225-I237 HydrophobicContact CD2-CD1 4.13Å; L225-I237 HydrophobicContact CD2-CG1 4.09Å; K233-I237 WeakPolarHBondContact O-CG1 3.49Å; K233-I237 PolarHBondContact O-N 2.84Å; T234-I237 PolarHBondContact O-N 3.34Å; I237-E239 PolarHBondContact O-N 2.88Å; I237-L240 PolarHBondContact O-N 3.45Å; I237-I241 HydrophobicContact CG2-CD1 4.01Å; I237-I241 WeakPolarHBondContact O-CG1 3.16Å; I237-I241 PolarHBondContact O-N 2.9Å; I237-F254 HydrophobicContact CG2-CE2 4.46Å; I237-F327 HydrophobicContact CB-CD1 4.18Å; I237-F327 HydrophobicContact CB-CE1 4.15Å; I237-F327 HydrophobicContact CD1-CD1 4.46Å; I237-F327 HydrophobicContact CG1-CD1 3.92Å; I237-F327 HydrophobicContact CG1-CE1 4.11Å; I237-F327 HydrophobicContact CG2-CD1 3.51Å; I237-F327 HydrophobicContact CG2-CE1 3.68Å; I237-F327 HydrophobicContact CG2-CG 3.99Å; I237-F327 HydrophobicContact CG2-CZ 4.31Å
238	M	87.6	Confident	84.5	Confident	4 Å²	4	33 Å²	33	2%	0.02	22%	0.223	C	C	.	.	H	α-helix	trans	-64.3	-39.9	179.3	-69.6	-171.2	-67.3	0	0	112.4	T234 V235 L236 I241 N242 L267 E270 V493	T234-M238 HydrophobicContact CG2-CE 4.01Å; T234-M238 WeakPolarHBondContact O-CG 3.22Å; T234-M238 PolarHBondContact O-N 3.06Å; V235-M238 HydrophobicContact CG2-CE 4.43Å; L236-M238 PolarHBondContact O-N 3.33Å; M238-I241 PolarHBondContact O-N 3.43Å; M238-N242 WeakPolarHBondContact O-CB 3.39Å; M238-N242 PolarHBondContact O-N 3.34Å; M238-L267 HydrophobicContact CG-CD1 3.93Å; M238-L267 HydrophobicContact SD-CD1 4.1Å; M238-E270 HydrophobicContact CE-CB 4.13Å; M238-E270 WeakPolarHBondContact CE-OE2 3.09Å; M238-E270 HydrophobicContact SD-CB 3.61Å; M238-V493 HydrophobicContact CB-CB 4.22Å; M238-V493 HydrophobicContact CB-CG1 4Å; M238-V493 HydrophobicContact CB-CG2 4.08Å
239	E	90.5	Very high	84.1	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.3	-40.9	176.6	-174.1	66.3	-176.4	0	0	111.4	I208 V235 L236 I237 I241 N242 N243 F491 H492 V493	I208-E239 HydrophobicContact CD1-CG 4.22Å; V235-E239 WeakPolarHBondContact O-CB 3.5Å; V235-E239 PolarHBondContact O-N 2.65Å; L236-E239 PolarHBondContact O-N 3.35Å; I237-E239 PolarHBondContact O-N 2.88Å; E239-I241 PolarHBondContact O-N 3.18Å; E239-N242 PolarHBondContact O-N 2.71Å; E239-N243 WeakPolarHBondContact CG-ND2 3.28Å; E239-N243 WeakPolarHBondContact O-CB 3.1Å; E239-N243 VanDerWaalsContact O-CG 3.31Å; E239-N243 PolarHBondContact O-N 2.72Å; E239-N243 PolarHBondContact OE1-ND2 3.22Å; E239-N243 PolarHBondContact OE1-OD1 2.79Å; E239-N243 VanDerWaalsContact OE1-OD1 3.04Å; E239-F491 HydrophobicContact CB-CB 4.34Å; E239-F491 HydrophobicContact CB-CD2 3.63Å; E239-F491 HydrophobicContact CB-CE2 3.94Å; E239-F491 HydrophobicContact CB-CG 3.96Å; E239-F491 HydrophobicContact CB-CZ 4.49Å; E239-F491 HydrophobicContact CG-CB 3.97Å; E239-F491 HydrophobicContact CG-CD1 3.76Å; E239-F491 HydrophobicContact CG-CD2 3.77Å; E239-F491 HydrophobicContact CG-CE1 4.09Å; E239-F491 HydrophobicContact CG-CE2 4.13Å; E239-F491 HydrophobicContact CG-CG 3.58Å; E239-F491 HydrophobicContact CG-CZ 4.26Å; E239-H492 IonicContact OE1-CE1 3.66Å; E239-H492 IonicContact OE1-CG 3.42Å; E239-H492 PolarHBondContact OE1-N 2.87Å; E239-H492 IonicContact OE1-ND1 3.78Å; E239-H492 PolarHBondContact OE1-ND1 2.95Å; E239-H492 PolarHBondContact OE2-N 3.23Å; E239-H492 IonicContact OE2-ND1 3.34Å; E239-V493 HydrophobicContact CB-CG2 3.91Å; E239-V493 PolarHBondContact OE2-N 3.48Å
240	L	90.9	Very high	84.2	Confident	3 Å²	3	28.8 Å²	28.8	2%	0.016	19%	0.188	C	C	.	.	H	α-helix	trans	-60	-44.5	174.7	-72.9	171.7	0	0	0	111.6	T206 I208 Y217 L236 I237 N242 V244 F327 V380	T206-L240 HydrophobicContact CG2-CD2 3.66Å; I208-L240 HydrophobicContact CD1-CD2 3.79Å; I208-L240 HydrophobicContact CD1-CG 4.21Å; Y217-L240 HydrophobicContact CE2-CD1 4.07Å; Y217-L240 HydrophobicContact CE2-CD2 4.13Å; L236-L240 HydrophobicContact CG-CD1 4.23Å; L236-L240 VanDerWaalsContact O-CG 3.3Å; L236-L240 WeakPolarHBondContact O-CG 3.37Å; L236-L240 PolarHBondContact O-N 3.39Å; I237-L240 PolarHBondContact O-N 3.45Å; L240-N242 PolarHBondContact O-N 2.82Å; L240-V244 WeakPolarHBondContact O-CB 3.22Å; L240-V244 WeakPolarHBondContact O-CG2 3.38Å; L240-V244 PolarHBondContact O-N 2.78Å; L240-F327 HydrophobicContact CB-CE1 4.44Å; L240-F327 HydrophobicContact CB-CZ 4.18Å; L240-F327 HydrophobicContact CD1-CE1 4.45Å; L240-V380 HydrophobicContact CD1-CG2 4.27Å
241	I	86.9	Confident	84.6	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-58.8	-49.6	175.5	-66.5	164.7	0	0	0	110.4	I237 M238 E239 A245 M271 V276 F327	I237-I241 HydrophobicContact CG2-CD1 4.01Å; I237-I241 WeakPolarHBondContact O-CG1 3.16Å; I237-I241 PolarHBondContact O-N 2.9Å; M238-I241 PolarHBondContact O-N 3.43Å; E239-I241 PolarHBondContact O-N 3.18Å; I241-A245 WeakPolarHBondContact O-CB 3.2Å; I241-A245 PolarHBondContact O-N 3.49Å; I241-M271 HydrophobicContact CD1-CE 3.62Å; I241-V276 HydrophobicContact CG2-CG1 3.56Å; I241-V276 HydrophobicContact CG2-CG2 4.27Å; I241-F327 HydrophobicContact CD1-CD2 4.09Å; I241-F327 HydrophobicContact CD1-CE2 3.77Å; I241-F327 HydrophobicContact CD1-CZ 4.18Å; I241-F327 HydrophobicContact CG1-CD2 4.05Å; I241-F327 HydrophobicContact CG1-CE1 4.49Å; I241-F327 HydrophobicContact CG1-CE2 3.23Å; I241-F327 HydrophobicContact CG1-CZ 3.5Å; I241-F327 VanDerWaalsContact CG1-CZ 3.5Å
242	N	86.1	Confident	84.9	Confident	21 Å²	21	25.8 Å²	25.8	11%	0.112	15%	0.153	C	C	.	.	H	α-helix	trans	-63.2	-46	-178.6	173.6	75.9	0	0	0	112.3	M238 E239 L240 K246 H492 V493	M238-N242 WeakPolarHBondContact O-CB 3.39Å; M238-N242 PolarHBondContact O-N 3.34Å; E239-N242 PolarHBondContact O-N 2.71Å; L240-N242 PolarHBondContact O-N 2.82Å; N242-K246 PolarHBondContact ND2-NZ 2.81Å; N242-K246 VanDerWaalsContact ND2-NZ 3.14Å; N242-K246 WeakPolarHBondContact O-CB 3.49Å; N242-K246 VanDerWaalsContact O-CG 3.27Å; N242-K246 WeakPolarHBondContact O-CG 3.27Å; N242-K246 PolarHBondContact O-N 3.34Å; N242-K246 WeakPolarHBondContact OD1-CE 3.27Å; N242-K246 PolarHBondContact OD1-NZ 3.01Å; N242-H492 WeakPolarHBondContact ND2-CB 3.44Å; N242-V493 HydrophobicContact CB-CG1 4.13Å
243	N	87.3	Confident	85.3	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-73.1	-41.9	-174.7	-71.1	-4.3	0	0	0	111.9	T206 E239 K246 A247 H492 Y504	T206-N243 WeakPolarHBondContact O-CB 3.39Å; T206-N243 PolarHBondContact O-ND2 3.31Å; E239-N243 WeakPolarHBondContact CG-ND2 3.28Å; E239-N243 WeakPolarHBondContact O-CB 3.1Å; E239-N243 VanDerWaalsContact O-CG 3.31Å; E239-N243 PolarHBondContact O-N 2.72Å; E239-N243 PolarHBondContact OE1-ND2 3.22Å; E239-N243 PolarHBondContact OE1-OD1 2.79Å; E239-N243 VanDerWaalsContact OE1-OD1 3.04Å; N243-K246 PolarHBondContact O-N 2.76Å; N243-A247 VanDerWaalsContact O-CB 3.27Å; N243-A247 WeakPolarHBondContact O-CB 3.42Å; N243-A247 PolarHBondContact O-N 3.29Å; N243-H492 PolarHBondContact OD1-ND1 3.02Å; N243-Y504 HydrophobicContact CB-CD2 4.04Å; N243-Y504 HydrophobicContact CB-CE2 4.11Å
244	V	83.4	Confident	85.7	Confident	7 Å²	7	22.7 Å²	22.7	4%	0.042	13%	0.134	C	C	.	.	H	α-helix	trans	-70.2	-38.2	177.5	173.5	0	0	0	0	111.2	L204 L240 K246 A247 H248 G249 L325	L204-V244 HydrophobicContact CD1-CG1 4.42Å; L204-V244 HydrophobicContact CD2-CG2 4.35Å; L240-V244 WeakPolarHBondContact O-CB 3.22Å; L240-V244 WeakPolarHBondContact O-CG2 3.38Å; L240-V244 PolarHBondContact O-N 2.78Å; V244-K246 VanDerWaalsContact C-N 3.31Å; V244-K246 PolarHBondContact O-N 3.31Å; V244-A247 PolarHBondContact O-N 3.3Å; V244-H248 HydrophobicContact CG1-CB 4.45Å; V244-H248 PolarHBondContact O-N 2.87Å; V244-G249 PolarHBondContact O-N 2.78Å; V244-L325 HydrophobicContact CB-CD1 3.66Å; V244-L325 HydrophobicContact CB-CG 4.38Å; V244-L325 HydrophobicContact CG1-CD1 3.81Å; V244-L325 HydrophobicContact CG1-CD2 4.39Å; V244-L325 HydrophobicContact CG1-CG 3.96Å; V244-L325 HydrophobicContact CG2-CD1 3.84Å
245	A	79.9	Confident	86.3	Confident	18 Å²	18	20 Å²	20	15%	0.149	12%	0.117	C	C	.	.	H	α-helix	trans	-63.1	-36.7	174	0	0	0	0	0	112.5	I241 G249 K287	I241-A245 WeakPolarHBondContact O-CB 3.2Å; I241-A245 PolarHBondContact O-N 3.49Å; A245-G249 VanDerWaalsContact O-CA 3.27Å; A245-G249 WeakPolarHBondContact O-CA 3.47Å; A245-G249 PolarHBondContact O-N 2.83Å; A245-K287 HydrophobicContact CB-CB 4.49Å; A245-K287 HydrophobicContact CB-CG 4.42Å
246	K	78.3	Confident	86.6	Confident	126 Å²	126	18 Å²	18	55%	0.548	11%	0.105	S	C	.	.	H	α-helix	trans	-73.4	-41.9	176.3	-76.1	173.8	-178.3	169.4	0	113.1	N242 N243 V244	N242-K246 PolarHBondContact ND2-NZ 2.81Å; N242-K246 VanDerWaalsContact ND2-NZ 3.14Å; N242-K246 WeakPolarHBondContact O-CB 3.49Å; N242-K246 VanDerWaalsContact O-CG 3.27Å; N242-K246 WeakPolarHBondContact O-CG 3.27Å; N242-K246 PolarHBondContact O-N 3.34Å; N242-K246 WeakPolarHBondContact OD1-CE 3.27Å; N242-K246 PolarHBondContact OD1-NZ 3.01Å; N243-K246 PolarHBondContact O-N 2.76Å; V244-K246 VanDerWaalsContact C-N 3.31Å; V244-K246 PolarHBondContact O-N 3.31Å
247	A	75.1	Confident	86.8	Confident	49 Å²	49	17.9 Å²	17.9	41%	0.405	10%	0.104	S	C	.	.	H	α-helix	trans	-81	-42.8	-174.3	0	0	0	0	0	113	N243 V244 Y504	N243-A247 VanDerWaalsContact O-CB 3.27Å; N243-A247 WeakPolarHBondContact O-CB 3.42Å; N243-A247 PolarHBondContact O-N 3.29Å; V244-A247 PolarHBondContact O-N 3.3Å; A247-Y504 HydrophobicContact CB-CE2 4.11Å
248	H	74.4	Confident	86.9	Confident	87 Å²	87	17.8 Å²	17.8	40%	0.403	11%	0.105	S	C	.	.	H	α-helix	trans	-113.5	-8.4	-171.5	-58.6	-74.6	0	0	0	113.5	V205 V244 G250	V205-H248 PolarHBondContact O-NE2 3.46Å; V244-H248 HydrophobicContact CG1-CB 4.45Å; V244-H248 PolarHBondContact O-N 2.87Å; H248-G250 PolarHBondContact O-N 2.64Å
249	G	71.8	Confident	87	Confident	34 Å²	34	18.6 Å²	18.6	35%	0.351	11%	0.108	S	C	.	.			trans	73	8.1	179.9	0	0	0	0	0	115.1	V244 A245	V244-G249 PolarHBondContact O-N 2.78Å; A245-G249 VanDerWaalsContact O-CA 3.27Å; A245-G249 WeakPolarHBondContact O-CA 3.47Å; A245-G249 PolarHBondContact O-N 2.83Å
250	G	81.3	Confident	87	Confident	3 Å²	3	24.1 Å²	24.1	3%	0.031	13%	0.129	C	C	.	.			trans	-69.8	165.1	-174.8	0	0	0	0	0	115	H248 D323	H248-G250 PolarHBondContact O-N 2.64Å; G250-D323 VanDerWaalsContact CA-O 3.25Å; G250-D323 WeakPolarHBondContact CA-O 3.45Å
251	F	90.9	Very high	86.9	Confident	13 Å²	13	27.2 Å²	27.2	6%	0.057	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	156.3	172.3	-63.9	-66.9	0	0	0	110.7	L162 K287 F316 Q322 D323 V324 L325	L162-F251 HydrophobicContact CD1-CD1 3.81Å; L162-F251 HydrophobicContact CD1-CE1 3.49Å; L162-F251 VanDerWaalsContact CD1-CE1 3.49Å; L162-F251 HydrophobicContact CD1-CZ 4.17Å; L162-F251 HydrophobicContact CD2-CD1 3.82Å; L162-F251 HydrophobicContact CD2-CE1 4.38Å; L162-F251 HydrophobicContact CD2-CG 4.4Å; F251-K287 HydrophobicContact CD1-CD 4.44Å; F251-K287 HydrophobicContact CE1-CD 4.43Å; F251-F316 HydrophobicContact CB-CD2 4.44Å; F251-F316 HydrophobicContact CB-CG 4.45Å; F251-F316 HydrophobicContact CD2-CB 4.44Å; F251-F316 AromaticContact CD2-CD1 3.71Å; F251-F316 HydrophobicContact CD2-CD1 3.71Å; F251-F316 HydrophobicContact CD2-CE1 4.14Å; F251-F316 HydrophobicContact CD2-CG 4.1Å; F251-F316 HydrophobicContact CE2-CD1 4.08Å; F251-F316 HydrophobicContact CE2-CE1 4.34Å; F251-F316 HydrophobicContact CG-CD1 4.32Å; F251-F316 HydrophobicContact CG-CE1 4.46Å; F251-Q322 HydrophobicContact CD2-CB 4.4Å; F251-Q322 HydrophobicContact CD2-CG 4.23Å; F251-Q322 HydrophobicContact CE2-CG 4.16Å; F251-D323 PolarHBondContact N-O 3.2Å; F251-V324 CarbonylContact O-C 3.52Å; F251-V324 VanDerWaalsContact O-CA 3.27Å; F251-V324 WeakPolarHBondContact O-CA 3.44Å; F251-V324 WeakPolarHBondContact O-CG1 3.5Å; F251-L325 PolarHBondContact O-N 3.26Å
252	S	93.1	Very high	87.1	Confident	2 Å²	2	34 Å²	34	1%	0.014	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	146.1	174.4	-61.2	0	0	0	0	110.7	K287 C288 A289 L325	S252-K287 PolarHBondContact N-O 3.06Å; S252-C288 CarbonylContact O-C 3.57Å; S252-C288 VanDerWaalsContact O-CA 3.24Å; S252-C288 WeakPolarHBondContact O-CA 3.04Å; S252-A289 PolarHBondContact O-N 3.24Å; S252-L325 CarbonylContact C-O 3.53Å; S252-L325 VanDerWaalsContact CA-O 3.25Å; S252-L325 WeakPolarHBondContact CA-O 3.35Å
253	V	95.2	Very high	87.1	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	127.4	169.9	-176.5	0	0	0	0	107.9	A289 V291 G309 V312 A313 F316 V324 L325 L326 F327	V253-A289 CarbonylContact C-O 3.47Å; V253-A289 WeakPolarHBondContact CA-O 3.47Å; V253-V291 HydrophobicContact CG1-CG2 4.48Å; V253-G309 WeakPolarHBondContact CG1-O 3.45Å; V253-V312 HydrophobicContact CG1-CB 4.35Å; V253-V312 HydrophobicContact CG1-CG1 4.4Å; V253-V312 HydrophobicContact CG2-CB 4.48Å; V253-V312 HydrophobicContact CG2-CG1 3.99Å; V253-A313 HydrophobicContact CB-CB 4.29Å; V253-A313 HydrophobicContact CG2-CB 3.94Å; V253-F316 HydrophobicContact CG2-CD2 4.34Å; V253-F316 HydrophobicContact CG2-CE2 4.38Å; V253-V324 HydrophobicContact CG2-CG1 4.21Å; V253-L325 PolarHBondContact N-O 3.1Å; V253-L326 HydrophobicContact CB-CD1 4.08Å; V253-L326 HydrophobicContact CG1-CD1 4.19Å; V253-L326 CarbonylContact O-C 3.4Å; V253-L326 WeakPolarHBondContact O-CA 3.34Å; V253-F327 PolarHBondContact O-N 2.87Å
254	F	95	Very high	87.1	Confident	3 Å²	3	36.3 Å²	36.3	1%	0.013	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	120.2	176.6	-174.1	-86.6	0	0	0	109.7	I237 L267 A289 L290 V291 Y292 F327 D329	I237-F254 HydrophobicContact CG2-CE2 4.46Å; F254-L267 HydrophobicContact CD1-CD2 4.04Å; F254-L267 HydrophobicContact CD2-CD2 3.95Å; F254-L267 HydrophobicContact CE1-CD2 3.63Å; F254-L267 HydrophobicContact CE2-CD2 3.53Å; F254-L267 HydrophobicContact CG-CD2 4.2Å; F254-L267 HydrophobicContact CZ-CD2 3.36Å; F254-A289 PolarHBondContact N-O 2.57Å; F254-L290 HydrophobicContact CB-CG 4.38Å; F254-L290 CarbonylContact O-C 3.49Å; F254-L290 WeakPolarHBondContact O-CA 3.41Å; F254-V291 PolarHBondContact O-N 3.11Å; F254-Y292 HydrophobicContact CD1-CE1 4.22Å; F254-Y292 AromaticContact CE1-CE1 3.82Å; F254-Y292 HydrophobicContact CE1-CE1 3.82Å; F254-F327 HydrophobicContact CD2-CB 3.55Å; F254-F327 HydrophobicContact CD2-CG 4.3Å; F254-F327 HydrophobicContact CE2-CB 4.09Å; F254-F327 HydrophobicContact CG-CB 4.37Å; F254-D329 HydrophobicContact CE2-CB 4.24Å; F254-D329 HydrophobicContact CZ-CB 3.81Å
255	A	95.9	Very high	87.4	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	102.5	174.9	0	0	0	0	0	109.6	V257 V291 F327 I328 D329	A255-V257 PolarHBondContact O-N 2.54Å; A255-V291 CarbonylContact C-O 3.59Å; A255-V291 WeakPolarHBondContact CA-O 2.99Å; A255-F327 PolarHBondContact N-O 2.97Å; A255-I328 WeakPolarHBondContact O-CA 3.25Å; A255-D329 PolarHBondContact O-N 3.19Å; A255-D329 VanDerWaalsContact O-N 3.09Å
256	G	95	Very high	87.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	97.2	174.3	0	0	0	0	0	110.9	V291 G293 D329	G256-V291 PolarHBondContact N-O 2.83Å; G256-G293 PolarHBondContact O-N 2.97Å; G256-D329 CarbonylContact C-O 3.57Å; G256-D329 VanDerWaalsContact CA-O 3.3Å; G256-D329 WeakPolarHBondContact CA-O 3.2Å
257	V	95.1	Very high	88.3	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	109.7	-178.7	-167	0	0	0	0	110.7	A255 E259 R302 V305 I328 D329 N330 R333 F334	A255-V257 PolarHBondContact O-N 2.54Å; V257-E259 PolarHBondContact O-N 3.46Å; V257-R302 VanDerWaalsContact CG1-O 3.24Å; V257-R302 WeakPolarHBondContact CG1-O 3.39Å; V257-V305 HydrophobicContact CB-CG1 4.04Å; V257-V305 HydrophobicContact CG1-CG1 3.72Å; V257-V305 HydrophobicContact CG2-CG1 3.89Å; V257-I328 HydrophobicContact CG2-CG2 3.74Å; V257-D329 PolarHBondContact N-O 2.86Å; V257-N330 PolarHBondContact O-N 3.46Å; V257-R333 HydrophobicContact CB-CB 4.49Å; V257-R333 HydrophobicContact CG1-CB 4.17Å; V257-R333 WeakPolarHBondContact O-CB 3.33Å; V257-R333 WeakPolarHBondContact O-CG 3.45Å; V257-F334 HydrophobicContact CG1-CB 3.99Å
258	G	92.1	Very high	89.1	Confident	3 Å²	3	33.8 Å²	33.8	3%	0.031	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	58.6	34.6	-176.7	0	0	0	0	0	112.2	G293 M295	G258-G293 VanDerWaalsContact CA-O 3.27Å; G258-G293 WeakPolarHBondContact CA-O 3.45Å; G258-G293 PolarHBondContact N-O 3.39Å; G258-M295 WeakPolarHBondContact O-CG 3.2Å
259	E	87.9	Confident	89.8	Confident	20 Å²	20	36.2 Å²	36.2	9%	0.093	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	152.6	176.8	-81	-59.6	133.4	0	0	111.4	V257 M295 D329	V257-E259 PolarHBondContact O-N 3.46Å; E259-M295 WeakPolarHBondContact O-CG 3.45Å; E259-M295 PolarHBondContact O-N 3.13Å; E259-M295 VanDerWaalsContact O-N 3.09Å; E259-D329 HydrophobicContact CG-CB 4.45Å; E259-D329 WeakPolarHBondContact CG-O 3.46Å; E259-D329 VanDerWaalsContact OE1-C 3.27Å
260	R	91.6	Very high	90.5	Very high	117 Å²	117	37.3 Å²	37.3	44%	0.442	17%	0.168	S	C	.	.			trans	-72	134.1	171.4	-65.3	-177.6	-173.4	80.2	2	108.7	R262 E263 G264 M295	R260-R262 PolarHBondContact O-N 3.03Å; R260-R262 VanDerWaalsContact O-N 3.09Å; R260-E263 HydrophobicContact CB-CB 4.24Å; R260-E263 HydrophobicContact CB-CG 4.11Å; R260-E263 WeakPolarHBondContact CB-OE2 3.28Å; R260-E263 WeakPolarHBondContact CD-OE2 3.48Å; R260-E263 WeakPolarHBondContact CG-OE2 3.35Å; R260-E263 IonicContact CZ-OE2 3.63Å; R260-E263 IonicContact NH1-OE1 3.66Å; R260-E263 PolarHBondContact NH1-OE1 2.86Å; R260-E263 IonicContact NH1-OE2 2.83Å; R260-E263 PolarHBondContact NH1-OE2 3.49Å; R260-E263 PolarHBondContact O-N 3.3Å; R260-G264 PolarHBondContact O-N 2.91Å; R260-M295 HydrophobicContact CG-SD 3.47Å; R260-M295 WeakPolarHBondContact CG-SD 3.25Å
261	T	89.3	Confident	90.8	Very high	67 Å²	67	37.2 Å²	37.2	41%	0.411	17%	0.167	S	C	.	.	H	α-helix	trans	-53.6	-35.6	177.7	-45	0	0	0	0	112.5	N265 Q294	T261-N265 VanDerWaalsContact O-CB 3.28Å; T261-N265 WeakPolarHBondContact O-CB 3.38Å; T261-N265 PolarHBondContact O-N 2.78Å; T261-Q294 PolarHBondContact OG1-OE1 2.85Å
262	R	90.4	Very high	90.7	Very high	144 Å²	144	39.1 Å²	39.1	54%	0.543	18%	0.177	S	C	.	.	H	α-helix	trans	-62.4	-48.7	174.3	-173.4	-172.8	56.7	64.4	4.4	112	R260 N265 D266	R260-R262 PolarHBondContact O-N 3.03Å; R260-R262 VanDerWaalsContact O-N 3.09Å; R262-N265 PolarHBondContact O-N 3.41Å; R262-D266 IonicContact NH1-OD2 2.75Å; R262-D266 PolarHBondContact NH1-OD2 3.44Å; R262-D266 WeakPolarHBondContact O-CB 3.34Å; R262-D266 PolarHBondContact O-N 3.31Å
263	E	86	Confident	90.3	Very high	63 Å²	63	46.1 Å²	46.1	29%	0.294	21%	0.21	S	C	.	.	H	α-helix	trans	-65.7	-42.9	-176.9	-69.4	168.5	171.6	0	0	110.7	R260 D266 L267	R260-E263 HydrophobicContact CB-CB 4.24Å; R260-E263 HydrophobicContact CB-CG 4.11Å; R260-E263 WeakPolarHBondContact CB-OE2 3.28Å; R260-E263 WeakPolarHBondContact CD-OE2 3.48Å; R260-E263 WeakPolarHBondContact CG-OE2 3.35Å; R260-E263 IonicContact CZ-OE2 3.63Å; R260-E263 IonicContact NH1-OE1 3.66Å; R260-E263 PolarHBondContact NH1-OE1 2.86Å; R260-E263 IonicContact NH1-OE2 2.83Å; R260-E263 PolarHBondContact NH1-OE2 3.49Å; R260-E263 PolarHBondContact O-N 3.3Å; E263-D266 PolarHBondContact O-N 3.47Å; E263-L267 WeakPolarHBondContact O-CB 3.3Å; E263-L267 PolarHBondContact O-N 3.02Å
264	G	87.5	Confident	89.6	Confident	7 Å²	7	48.1 Å²	48.1	7%	0.072	22%	0.223	C	C	.	.	H	α-helix	trans	-63.7	-40.7	173.6	0	0	0	0	0	113.6	R260 Y268 Y292	R260-G264 PolarHBondContact O-N 2.91Å; G264-Y268 WeakPolarHBondContact O-CB 3.39Å; G264-Y268 PolarHBondContact O-N 2.66Å; G264-Y292 PolarHBondContact O-OH 3.44Å
265	N	90.5	Very high	88.9	Confident	56 Å²	56	49.7 Å²	49.7	30%	0.299	24%	0.241	S	C	.	.	H	α-helix	trans	-65.8	-42.6	175	165.7	86.2	0	0	0	112.2	T261 R262 Y268 R269	T261-N265 VanDerWaalsContact O-CB 3.28Å; T261-N265 WeakPolarHBondContact O-CB 3.38Å; T261-N265 PolarHBondContact O-N 2.78Å; R262-N265 PolarHBondContact O-N 3.41Å; N265-Y268 PolarHBondContact O-N 3.07Å; N265-R269 PolarHBondContact ND2-NE 2.87Å; N265-R269 PolarHBondContact ND2-NH1 2.79Å; N265-R269 WeakPolarHBondContact O-CG 3.21Å; N265-R269 PolarHBondContact O-N 3.01Å; N265-R269 VanDerWaalsContact O-N 3.09Å; N265-R269 PolarHBondContact OD1-NE 3.38Å; N265-R269 PolarHBondContact OD1-NH2 2.74Å
266	D	88.9	Confident	88.2	Confident	53 Å²	53	50.1 Å²	50.1	28%	0.283	24%	0.243	S	C	.	.	H	α-helix	trans	-63.4	-47.7	179	-66.1	-15.3	0	0	0	109.7	R262 E263 Y268 R269 E270	R262-D266 IonicContact NH1-OD2 2.75Å; R262-D266 PolarHBondContact NH1-OD2 3.44Å; R262-D266 WeakPolarHBondContact O-CB 3.34Å; R262-D266 PolarHBondContact O-N 3.31Å; E263-D266 PolarHBondContact O-N 3.47Å; D266-Y268 VanDerWaalsContact C-N 3.34Å; D266-Y268 PolarHBondContact O-N 2.76Å; D266-R269 PolarHBondContact O-N 2.84Å; D266-R269 VanDerWaalsContact O-N 3.17Å; D266-E270 WeakPolarHBondContact O-CG 3.4Å; D266-E270 PolarHBondContact O-N 3.04Å
267	L	87.7	Confident	87.9	Confident	11 Å²	11	50.2 Å²	50.2	6%	0.058	24%	0.244	C	C	.	.	H	α-helix	trans	-56.6	-44.9	174.7	178.7	66.9	0	0	0	112.2	T234 M238 F254 E263 R269 E270 M271	T234-L267 HydrophobicContact CG2-CD1 3.59Å; M238-L267 HydrophobicContact CG-CD1 3.93Å; M238-L267 HydrophobicContact SD-CD1 4.1Å; F254-L267 HydrophobicContact CD1-CD2 4.04Å; F254-L267 HydrophobicContact CD2-CD2 3.95Å; F254-L267 HydrophobicContact CE1-CD2 3.63Å; F254-L267 HydrophobicContact CE2-CD2 3.53Å; F254-L267 HydrophobicContact CG-CD2 4.2Å; F254-L267 HydrophobicContact CZ-CD2 3.36Å; E263-L267 WeakPolarHBondContact O-CB 3.3Å; E263-L267 PolarHBondContact O-N 3.02Å; L267-R269 VanDerWaalsContact C-N 3.33Å; L267-R269 PolarHBondContact O-N 2.98Å; L267-E270 PolarHBondContact O-N 3.29Å; L267-M271 HydrophobicContact CD1-CE 3.76Å; L267-M271 HydrophobicContact CD1-CG 4.37Å; L267-M271 HydrophobicContact CD2-CE 4.02Å; L267-M271 HydrophobicContact CG-CE 3.86Å; L267-M271 WeakPolarHBondContact O-CB 3.46Å; L267-M271 WeakPolarHBondContact O-CG 3.36Å; L267-M271 PolarHBondContact O-N 3.43Å
268	Y	90.8	Very high	87.5	Confident	26 Å²	26	53.7 Å²	53.7	10%	0.102	26%	0.259	C	S	.	.	H	α-helix	trans	-61.9	-40.9	179.1	-180	-118.9	0	0	0	112.1	I165 G264 N265 D266 M271 I272 I277 L279 L290	I165-Y268 HydrophobicContact CD1-CD1 3.86Å; I165-Y268 HydrophobicContact CD1-CD2 3.74Å; I165-Y268 HydrophobicContact CD1-CE1 3.91Å; I165-Y268 HydrophobicContact CD1-CE2 3.81Å; I165-Y268 HydrophobicContact CD1-CG 3.77Å; I165-Y268 HydrophobicContact CG1-CD2 4.04Å; I165-Y268 HydrophobicContact CG1-CE2 3.89Å; G264-Y268 WeakPolarHBondContact O-CB 3.39Å; G264-Y268 PolarHBondContact O-N 2.66Å; N265-Y268 PolarHBondContact O-N 3.07Å; D266-Y268 VanDerWaalsContact C-N 3.34Å; D266-Y268 PolarHBondContact O-N 2.76Å; Y268-M271 PolarHBondContact O-N 2.79Å; Y268-I272 HydrophobicContact CD1-CD1 3.87Å; Y268-I272 HydrophobicContact CD2-CD1 4.46Å; Y268-I272 HydrophobicContact CE1-CD1 3.6Å; Y268-I272 HydrophobicContact CE2-CD1 4.22Å; Y268-I272 HydrophobicContact CG-CD1 4.31Å; Y268-I272 WeakPolarHBondContact O-CD1 3.46Å; Y268-I272 VanDerWaalsContact O-CG1 3.3Å; Y268-I272 WeakPolarHBondContact O-CG1 3.43Å; Y268-I272 PolarHBondContact O-N 3.14Å; Y268-I272 VanDerWaalsContact O-N 3.11Å; Y268-I277 HydrophobicContact CD2-CD1 3.55Å; Y268-I277 HydrophobicContact CE2-CD1 3.68Å; Y268-I277 HydrophobicContact CE2-CG2 4.21Å; Y268-L279 WeakPolarHBondContact OH-CD2 3.1Å; Y268-L290 HydrophobicContact CD2-CD1 4.26Å; Y268-L290 HydrophobicContact CD2-CD2 4.3Å; Y268-L290 HydrophobicContact CE2-CD1 4.46Å
269	R	90.5	Very high	87.3	Confident	139 Å²	139	57 Å²	57	53%	0.525	28%	0.276	S	S	.	.	H	α-helix	trans	-65.9	-45.2	176	-70.7	176.9	-175.1	169.3	2.4	111.7	N265 D266 L267 M271 I272 E273	N265-R269 PolarHBondContact ND2-NE 2.87Å; N265-R269 PolarHBondContact ND2-NH1 2.79Å; N265-R269 WeakPolarHBondContact O-CG 3.21Å; N265-R269 PolarHBondContact O-N 3.01Å; N265-R269 VanDerWaalsContact O-N 3.09Å; N265-R269 PolarHBondContact OD1-NE 3.38Å; N265-R269 PolarHBondContact OD1-NH2 2.74Å; D266-R269 PolarHBondContact O-N 2.84Å; D266-R269 VanDerWaalsContact O-N 3.17Å; L267-R269 VanDerWaalsContact C-N 3.33Å; L267-R269 PolarHBondContact O-N 2.98Å; R269-M271 VanDerWaalsContact C-N 3.29Å; R269-M271 PolarHBondContact O-N 2.89Å; R269-I272 WeakPolarHBondContact O-CB 3.46Å; R269-I272 PolarHBondContact O-N 3.27Å; R269-I272 VanDerWaalsContact O-N 3.09Å; R269-E273 WeakPolarHBondContact O-CG 3.47Å; R269-E273 PolarHBondContact O-N 2.91Å
270	E	85.9	Confident	87.1	Confident	57 Å²	57	58.8 Å²	58.8	27%	0.266	30%	0.299	S	S	.	.	H	α-helix	trans	-62	-36.8	176.8	-69.6	175.8	177.8	0	0	111.8	M238 D266 L267 I272 E273 S274	M238-E270 HydrophobicContact CE-CB 4.13Å; M238-E270 WeakPolarHBondContact CE-OE2 3.09Å; M238-E270 HydrophobicContact SD-CB 3.61Å; D266-E270 WeakPolarHBondContact O-CG 3.4Å; D266-E270 PolarHBondContact O-N 3.04Å; L267-E270 PolarHBondContact O-N 3.29Å; E270-I272 VanDerWaalsContact C-N 3.33Å; E270-I272 PolarHBondContact O-N 3.19Å; E270-E273 PolarHBondContact O-N 3.49Å; E270-S274 VanDerWaalsContact O-CB 3.31Å; E270-S274 WeakPolarHBondContact O-CB 3.28Å; E270-S274 PolarHBondContact O-N 2.97Å; E270-S274 PolarHBondContact O-OG 3.45Å
271	M	87.5	Confident	86.5	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-67	-31.5	174	-75.5	-166.4	-175.9	0	0	113.2	I241 L267 Y268 R269 S274 G275 V276 I277 C288 L290	I241-M271 HydrophobicContact CD1-CE 3.62Å; L267-M271 HydrophobicContact CD1-CE 3.76Å; L267-M271 HydrophobicContact CD1-CG 4.37Å; L267-M271 HydrophobicContact CD2-CE 4.02Å; L267-M271 HydrophobicContact CG-CE 3.86Å; L267-M271 WeakPolarHBondContact O-CB 3.46Å; L267-M271 WeakPolarHBondContact O-CG 3.36Å; L267-M271 PolarHBondContact O-N 3.43Å; Y268-M271 PolarHBondContact O-N 2.79Å; R269-M271 VanDerWaalsContact C-N 3.29Å; R269-M271 PolarHBondContact O-N 2.89Å; M271-S274 WeakPolarHBondContact CA-OG 3.27Å; M271-S274 PolarHBondContact O-OG 3.45Å; M271-G275 PolarHBondContact O-N 3.38Å; M271-V276 HydrophobicContact CB-CB 4.36Å; M271-V276 PolarHBondContact O-N 2.88Å; M271-V276 HydrophobicContact SD-CG1 4.4Å; M271-I277 HydrophobicContact CB-CB 4.35Å; M271-I277 HydrophobicContact CB-CD1 3.49Å; M271-I277 VanDerWaalsContact CB-CD1 3.49Å; M271-I277 HydrophobicContact CB-CG1 3.83Å; M271-I277 HydrophobicContact CG-CD1 4.28Å; M271-I277 PolarHBondContact O-N 2.9Å; M271-I277 HydrophobicContact SD-CD1 3.79Å; M271-I277 HydrophobicContact SD-CG1 4.31Å; M271-C288 HydrophobicContact SD-CB 4.32Å; M271-L290 HydrophobicContact SD-CD2 4.14Å
272	I	88.4	Confident	86.2	Confident	53 Å²	53	64 Å²	64	27%	0.272	33%	0.327	S	S	.	.	H	α-helix	trans	-71.3	-46.4	173.1	-66.9	158.7	0	0	0	110.2	Y268 R269 E270 G275 I277 L279	Y268-I272 HydrophobicContact CD1-CD1 3.87Å; Y268-I272 HydrophobicContact CD2-CD1 4.46Å; Y268-I272 HydrophobicContact CE1-CD1 3.6Å; Y268-I272 HydrophobicContact CE2-CD1 4.22Å; Y268-I272 HydrophobicContact CG-CD1 4.31Å; Y268-I272 WeakPolarHBondContact O-CD1 3.46Å; Y268-I272 VanDerWaalsContact O-CG1 3.3Å; Y268-I272 WeakPolarHBondContact O-CG1 3.43Å; Y268-I272 PolarHBondContact O-N 3.14Å; Y268-I272 VanDerWaalsContact O-N 3.11Å; R269-I272 WeakPolarHBondContact O-CB 3.46Å; R269-I272 PolarHBondContact O-N 3.27Å; R269-I272 VanDerWaalsContact O-N 3.09Å; E270-I272 VanDerWaalsContact C-N 3.33Å; E270-I272 PolarHBondContact O-N 3.19Å; I272-G275 PolarHBondContact O-N 3.28Å; I272-G275 VanDerWaalsContact O-N 3.14Å; I272-I277 HydrophobicContact CG1-CB 4.12Å; I272-I277 HydrophobicContact CG1-CG2 3.95Å; I272-L279 HydrophobicContact CD1-CD1 3.78Å; I272-L279 HydrophobicContact CD1-CD2 4.48Å; I272-L279 HydrophobicContact CD1-CG 4.34Å; I272-L279 HydrophobicContact CG1-CD1 4.18Å; I272-L279 HydrophobicContact CG1-CD2 4.5Å; I272-L279 HydrophobicContact CG1-CG 4.27Å; I272-L279 HydrophobicContact CG2-CD1 4.24Å
273	E	85.1	Confident	85.9	Confident	150 Å²	150	59.6 Å²	59.6	70%	0.701	31%	0.313	S	S	*	.	H	α-helix	trans	-64.7	-39.7	-179.1	-71.5	178	-174.5	0	0	112.4	R269 E270 G275	R269-E273 WeakPolarHBondContact O-CG 3.47Å; R269-E273 PolarHBondContact O-N 2.91Å; E270-E273 PolarHBondContact O-N 3.49Å; E273-G275 PolarHBondContact O-N 3.5Å
274	S	79.4	Confident	85.7	Confident	41 Å²	41	61.1 Å²	61.1	29%	0.287	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.7	175.1	58.2	0	0	0	0	113.9	E270 M271 V276	E270-S274 VanDerWaalsContact O-CB 3.31Å; E270-S274 WeakPolarHBondContact O-CB 3.28Å; E270-S274 PolarHBondContact O-N 2.97Å; E270-S274 PolarHBondContact O-OG 3.45Å; M271-S274 WeakPolarHBondContact CA-OG 3.27Å; M271-S274 PolarHBondContact O-OG 3.45Å; S274-V276 VanDerWaalsContact C-N 3.3Å; S274-V276 PolarHBondContact O-N 3.45Å
275	G	80.7	Confident	85.6	Confident	36 Å²	36	65 Å²	65	37%	0.371	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	9.9	179.6	0	0	0	0	0	115	M271 I272 E273 I277	M271-G275 PolarHBondContact O-N 3.38Å; I272-G275 PolarHBondContact O-N 3.28Å; I272-G275 VanDerWaalsContact O-N 3.14Å; E273-G275 PolarHBondContact O-N 3.5Å; G275-I277 VanDerWaalsContact C-N 3.33Å
276	V	82.3	Confident	85.5	Confident	10 Å²	10	62.3 Å²	62.3	6%	0.061	33%	0.332	C	S	.	.	S	Bend	trans	-64.9	-41.3	170.7	172.4	0	0	0	0	110.4	I241 M271 S274 K287 C288	I241-V276 HydrophobicContact CG2-CG1 3.56Å; I241-V276 HydrophobicContact CG2-CG2 4.27Å; M271-V276 HydrophobicContact CB-CB 4.36Å; M271-V276 PolarHBondContact O-N 2.88Å; M271-V276 HydrophobicContact SD-CG1 4.4Å; S274-V276 VanDerWaalsContact C-N 3.3Å; S274-V276 PolarHBondContact O-N 3.45Å; V276-K287 PolarHBondContact O-N 3.38Å; V276-K287 VanDerWaalsContact O-N 3.07Å; V276-C288 HydrophobicContact CG1-CB 3.87Å
277	I	87.4	Confident	85.4	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.01	34%	0.335	C	S	.	.	S	Bend	trans	-106.4	129.4	172.2	-64.2	172	0	0	0	108.3	Y268 M271 I272 G275 L279 C288 L290	Y268-I277 HydrophobicContact CD2-CD1 3.55Å; Y268-I277 HydrophobicContact CE2-CD1 3.68Å; Y268-I277 HydrophobicContact CE2-CG2 4.21Å; M271-I277 HydrophobicContact CB-CB 4.35Å; M271-I277 HydrophobicContact CB-CD1 3.49Å; M271-I277 VanDerWaalsContact CB-CD1 3.49Å; M271-I277 HydrophobicContact CB-CG1 3.83Å; M271-I277 HydrophobicContact CG-CD1 4.28Å; M271-I277 PolarHBondContact O-N 2.9Å; M271-I277 HydrophobicContact SD-CD1 3.79Å; M271-I277 HydrophobicContact SD-CG1 4.31Å; I272-I277 HydrophobicContact CG1-CB 4.12Å; I272-I277 HydrophobicContact CG1-CG2 3.95Å; G275-I277 VanDerWaalsContact C-N 3.33Å; I277-L279 HydrophobicContact CG2-CD2 3.95Å; I277-C288 HydrophobicContact CG1-CB 4.4Å; I277-L290 HydrophobicContact CD1-CD1 3.43Å; I277-L290 VanDerWaalsContact CD1-CD1 3.43Å; I277-L290 HydrophobicContact CD1-CD2 4.46Å; I277-L290 HydrophobicContact CG1-CD1 4.39Å
278	K	87.6	Confident	85.5	Confident	72 Å²	72	62.9 Å²	62.9	31%	0.313	33%	0.332	S	S	.	.			trans	-113.5	133.4	174.1	-70.4	169.8	176.5	175.9	0	108.3	K282 Q283 E285 S286	K278-K282 HydrophobicContact CB-CB 3.94Å; K278-K282 WeakPolarHBondContact CB-O 3.38Å; K278-K282 HydrophobicContact CD-CB 4.25Å; K278-Q283 VanDerWaalsContact O-CA 3.3Å; K278-Q283 WeakPolarHBondContact O-CA 3.36Å; K278-E285 HydrophobicContact CD-CB 3.67Å; K278-E285 WeakPolarHBondContact CD-OE2 2.99Å; K278-E285 IonicContact NZ-OE2 3.64Å; K278-E285 PolarHBondContact NZ-OE2 3.04Å; K278-S286 PolarHBondContact N-OG 2.99Å; K278-S286 PolarHBondContact O-OG 2.83Å
279	L	87.1	Confident	85.7	Confident	74 Å²	74	61.7 Å²	61.7	39%	0.387	33%	0.327	S	S	.	.			trans	-101.2	161.1	-179.9	-58.5	-179	0	0	0	111.3	Y268 I272 I277	Y268-L279 WeakPolarHBondContact OH-CD2 3.1Å; I272-L279 HydrophobicContact CD1-CD1 3.78Å; I272-L279 HydrophobicContact CD1-CD2 4.48Å; I272-L279 HydrophobicContact CD1-CG 4.34Å; I272-L279 HydrophobicContact CG1-CD1 4.18Å; I272-L279 HydrophobicContact CG1-CD2 4.5Å; I272-L279 HydrophobicContact CG1-CG 4.27Å; I272-L279 HydrophobicContact CG2-CD1 4.24Å; I277-L279 HydrophobicContact CG2-CD2 3.95Å
280	G	84.4	Confident	85.9	Confident	56 Å²	56	55 Å²	55	58%	0.577	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	74.2	-140.3	177.4	0	0	0	0	0	112.6	K282 Q283	G280-K282 PolarHBondContact O-N 3.42Å; G280-Q283 VanDerWaalsContact O-CB 3.31Å; G280-Q283 WeakPolarHBondContact O-CB 3.43Å; G280-Q283 PolarHBondContact O-N 3.35Å
281	D	79.4	Confident	86.4	Confident	172 Å²	172	52.3 Å²	52.3	92%	0.92	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-60.6	-21.7	-175.2	-57.9	-31.3	0	0	0	113.7	Q283	D281-Q283 VanDerWaalsContact C-N 3.35Å
282	K	82.8	Confident	86.8	Confident	122 Å²	122	52.7 Å²	52.7	53%	0.53	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-91.5	10.4	178.7	-62.3	-173.3	-179.1	-177.5	0	113.6	K278 G280 S284 E285	K278-K282 HydrophobicContact CB-CB 3.94Å; K278-K282 WeakPolarHBondContact CB-O 3.38Å; K278-K282 HydrophobicContact CD-CB 4.25Å; G280-K282 PolarHBondContact O-N 3.42Å; K282-S284 PolarHBondContact O-N 3.05Å; K282-E285 WeakPolarHBondContact O-CB 3.22Å; K282-E285 PolarHBondContact O-N 3.01Å
283	Q	83.8	Confident	87.1	Confident	52 Å²	52	50.2 Å²	50.2	24%	0.243	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-56.8	-37	-178.7	-169.3	-161.4	-53	0	0	112.7	L162 R164 K278 G280 D281 E285 S286	L162-Q283 WeakPolarHBondContact O-CG 3.33Å; L162-Q283 PolarHBondContact O-NE2 3.42Å; R164-Q283 VanDerWaalsContact CD-CD 3.48Å; R164-Q283 VanDerWaalsContact CG-NE2 3.35Å; K278-Q283 VanDerWaalsContact O-CA 3.3Å; K278-Q283 WeakPolarHBondContact O-CA 3.36Å; G280-Q283 VanDerWaalsContact O-CB 3.31Å; G280-Q283 WeakPolarHBondContact O-CB 3.43Å; G280-Q283 PolarHBondContact O-N 3.35Å; D281-Q283 VanDerWaalsContact C-N 3.35Å; Q283-E285 PolarHBondContact O-N 2.99Å; Q283-E285 VanDerWaalsContact O-N 3.15Å; Q283-S286 WeakPolarHBondContact O-CB 3.47Å; Q283-S286 PolarHBondContact O-N 3.44Å; Q283-S286 PolarHBondContact O-OG 3.32Å
284	S	82.1	Confident	87.5	Confident	94 Å²	94	44.9 Å²	44.9	66%	0.657	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-62.5	-17.6	176.2	56.8	0	0	0	0	114.2	K282	K282-S284 PolarHBondContact O-N 3.05Å
285	E	85.2	Confident	88.1	Confident	89 Å²	89	46.9 Å²	46.9	42%	0.416	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-88.6	-5.6	174.2	-61.1	178.4	-166.8	0	0	113	K278 K282 Q283	K278-E285 HydrophobicContact CD-CB 3.67Å; K278-E285 WeakPolarHBondContact CD-OE2 2.99Å; K278-E285 IonicContact NZ-OE2 3.64Å; K278-E285 PolarHBondContact NZ-OE2 3.04Å; K282-E285 WeakPolarHBondContact O-CB 3.22Å; K282-E285 PolarHBondContact O-N 3.01Å; Q283-E285 PolarHBondContact O-N 2.99Å; Q283-E285 VanDerWaalsContact O-N 3.15Å
286	S	89.3	Confident	88.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.271	C	S	.	.			trans	-61.1	145.4	176.1	-63.8	0	0	0	0	110.8	K278 Q283	K278-S286 PolarHBondContact N-OG 2.99Å; K278-S286 PolarHBondContact O-OG 2.83Å; Q283-S286 WeakPolarHBondContact O-CB 3.47Å; Q283-S286 PolarHBondContact O-N 3.44Å; Q283-S286 PolarHBondContact O-OG 3.32Å
287	K	85.3	Confident	89.2	Confident	76 Å²	76	51.8 Å²	51.8	33%	0.33	28%	0.275	S	S	.	.			trans	-107.3	-7.9	-176.1	-61.2	-60.3	-174.8	173.1	0	114	A245 F251 S252 V276	A245-K287 HydrophobicContact CB-CB 4.49Å; A245-K287 HydrophobicContact CB-CG 4.42Å; F251-K287 HydrophobicContact CD1-CD 4.44Å; F251-K287 HydrophobicContact CE1-CD 4.43Å; S252-K287 PolarHBondContact N-O 3.06Å; V276-K287 PolarHBondContact O-N 3.38Å; V276-K287 VanDerWaalsContact O-N 3.07Å
288	C	91.5	Very high	89.5	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	133.7	-175	-167.2	0	0	0	0	111.7	G163 S252 M271 V276 I277	G163-C288 PolarHBondContact N-O 3.25Å; S252-C288 CarbonylContact O-C 3.57Å; S252-C288 VanDerWaalsContact O-CA 3.24Å; S252-C288 WeakPolarHBondContact O-CA 3.04Å; M271-C288 HydrophobicContact SD-CB 4.32Å; V276-C288 HydrophobicContact CG1-CB 3.87Å; I277-C288 HydrophobicContact CG1-CB 4.4Å
289	A	94	Very high	89.9	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	139.2	164.7	0	0	0	0	0	109.6	T161 M166 S252 V253 F254 V312	T161-A289 WeakPolarHBondContact O-CB 3Å; M166-A289 HydrophobicContact CE-CB 4.4Å; S252-A289 PolarHBondContact O-N 3.24Å; V253-A289 CarbonylContact C-O 3.47Å; V253-A289 WeakPolarHBondContact CA-O 3.47Å; F254-A289 PolarHBondContact N-O 2.57Å; A289-V312 HydrophobicContact CB-CG1 4.2Å
290	L	95.2	Very high	90.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.5	-176.6	-58.5	93.8	0	0	0	110.8	R164 I165 M166 F254 Y268 M271 I277 Y292	R164-L290 PolarHBondContact O-N 3.06Å; I165-L290 CarbonylContact C-O 3.57Å; I165-L290 WeakPolarHBondContact CA-O 3.17Å; I165-L290 HydrophobicContact CG1-CB 4.24Å; I165-L290 HydrophobicContact CG2-CB 4.4Å; M166-L290 PolarHBondContact N-O 2.99Å; F254-L290 HydrophobicContact CB-CG 4.38Å; F254-L290 CarbonylContact O-C 3.49Å; F254-L290 WeakPolarHBondContact O-CA 3.41Å; Y268-L290 HydrophobicContact CD2-CD1 4.26Å; Y268-L290 HydrophobicContact CD2-CD2 4.3Å; Y268-L290 HydrophobicContact CE2-CD1 4.46Å; M271-L290 HydrophobicContact SD-CD2 4.14Å; I277-L290 HydrophobicContact CD1-CD1 3.43Å; I277-L290 VanDerWaalsContact CD1-CD1 3.43Å; I277-L290 HydrophobicContact CD1-CD2 4.46Å; I277-L290 HydrophobicContact CG1-CD1 4.39Å; L290-Y292 HydrophobicContact CB-CD2 4.44Å; L290-Y292 HydrophobicContact CB-CE2 3.83Å; L290-Y292 HydrophobicContact CD2-CE2 3.96Å; L290-Y292 WeakPolarHBondContact CD2-OH 3.33Å
291	V	96.4	Very high	90.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126.6	174.4	-168.9	0	0	0	0	107.7	M166 V253 F254 A255 G256 V305 T308	M166-V291 HydrophobicContact CE-CG2 3.87Å; M166-V291 HydrophobicContact CG-CB 4.15Å; M166-V291 HydrophobicContact CG-CG1 4Å; M166-V291 HydrophobicContact CG-CG2 3.71Å; M166-V291 WeakPolarHBondContact O-CA 3.32Å; M166-V291 HydrophobicContact SD-CG2 3.85Å; V253-V291 HydrophobicContact CG1-CG2 4.48Å; F254-V291 PolarHBondContact O-N 3.11Å; A255-V291 CarbonylContact C-O 3.59Å; A255-V291 WeakPolarHBondContact CA-O 2.99Å; G256-V291 PolarHBondContact N-O 2.83Å; V291-V305 HydrophobicContact CB-CG2 4.4Å; V291-V305 HydrophobicContact CG1-CG2 3.6Å; V291-T308 HydrophobicContact CG1-CG2 3.62Å; V291-T308 HydrophobicContact CG2-CG2 4.46Å
292	Y	95.9	Very high	91.6	Very high	8 Å²	8	36.8 Å²	36.8	3%	0.031	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	142.1	176.6	-69.8	-81.8	0	0	0	112.1	I165 M166 F254 G264 L290	I165-Y292 HydrophobicContact CG2-CD2 3.34Å; I165-Y292 HydrophobicContact CG2-CE2 3.7Å; M166-Y292 PolarHBondContact O-N 2.9Å; F254-Y292 HydrophobicContact CD1-CE1 4.22Å; F254-Y292 AromaticContact CE1-CE1 3.82Å; F254-Y292 HydrophobicContact CE1-CE1 3.82Å; G264-Y292 PolarHBondContact O-OH 3.44Å; L290-Y292 HydrophobicContact CB-CD2 4.44Å; L290-Y292 HydrophobicContact CB-CE2 3.83Å; L290-Y292 HydrophobicContact CD2-CE2 3.96Å; L290-Y292 WeakPolarHBondContact CD2-OH 3.33Å
293	G	94.1	Very high	92.2	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	97.6	164.2	0	0	0	0	0	106.9	G256 G258 E297 V305	G256-G293 PolarHBondContact O-N 2.97Å; G258-G293 VanDerWaalsContact CA-O 3.27Å; G258-G293 WeakPolarHBondContact CA-O 3.45Å; G258-G293 PolarHBondContact N-O 3.39Å; G293-E297 WeakPolarHBondContact CA-OE2 3.37Å; G293-V305 VanDerWaalsContact N-CG2 3.27Å
294	Q	93.5	Very high	92.8	Very high	38 Å²	38	30 Å²	30	18%	0.178	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	162.5	-164	-58.1	-174.1	-15.2	0	0	113	T261 N296 E297	T261-Q294 PolarHBondContact OG1-OE1 2.85Å; Q294-N296 VanDerWaalsContact C-N 3.25Å; Q294-N296 WeakPolarHBondContact CB-OD1 3.33Å; Q294-N296 PolarHBondContact O-N 2.89Å; Q294-N296 PolarHBondContact OE1-OD1 2.87Å; Q294-E297 HydrophobicContact CB-CG 4.16Å; Q294-E297 VanDerWaalsContact N-CD 3.25Å; Q294-E297 PolarHBondContact N-OE2 3.34Å; Q294-E297 WeakPolarHBondContact O-CB 3.41Å; Q294-E297 PolarHBondContact O-N 3.23Å; Q294-E297 VanDerWaalsContact O-N 3.12Å
295	M	91.7	Very high	93.5	Very high	84 Å²	84	25.5 Å²	25.5	41%	0.414	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-30.9	177.1	-76	-171.1	69.6	0	0	114.5	G258 E259 R260 E297	G258-M295 WeakPolarHBondContact O-CG 3.2Å; E259-M295 WeakPolarHBondContact O-CG 3.45Å; E259-M295 PolarHBondContact O-N 3.13Å; E259-M295 VanDerWaalsContact O-N 3.09Å; R260-M295 HydrophobicContact CG-SD 3.47Å; R260-M295 WeakPolarHBondContact CG-SD 3.25Å; M295-E297 VanDerWaalsContact C-N 3.27Å
296	N	91.4	Very high	94	Very high	116 Å²	116	21.3 Å²	21.3	62%	0.62	10%	0.104	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-9.4	178.5	59	-67.4	0	0	0	113.2	Q294	Q294-N296 VanDerWaalsContact C-N 3.25Å; Q294-N296 WeakPolarHBondContact CB-OD1 3.33Å; Q294-N296 PolarHBondContact O-N 2.89Å; Q294-N296 PolarHBondContact OE1-OD1 2.87Å
297	E	94.3	Very high	94.3	Very high	33 Å²	33	22 Å²	22	15%	0.154	11%	0.107	C	C	.	.	S	Bend	trans	-83.9	155.8	178.8	-70.2	172.6	-169.6	0	0	111.5	G293 Q294 M295 A301 R302	G293-E297 WeakPolarHBondContact CA-OE2 3.37Å; Q294-E297 HydrophobicContact CB-CG 4.16Å; Q294-E297 VanDerWaalsContact N-CD 3.25Å; Q294-E297 PolarHBondContact N-OE2 3.34Å; Q294-E297 WeakPolarHBondContact O-CB 3.41Å; Q294-E297 PolarHBondContact O-N 3.23Å; Q294-E297 VanDerWaalsContact O-N 3.12Å; M295-E297 VanDerWaalsContact C-N 3.27Å; E297-A301 HydrophobicContact CB-CB 4.02Å; E297-R302 PolarHBondContact O-NE 3.31Å
298	P	94.7	Very high	94.9	Very high	19 Å²	19	18.3 Å²	18.3	12%	0.123	9%	0.092	C	C	.	.			trans	-59.7	157.3	-179.5	27.6	-39	0	0	0	112.3	A90 G300 A301 R302	A90-P298 HydrophobicContact CB-CB 4.12Å; P298-G300 PolarHBondContact O-N 3.48Å; P298-G300 VanDerWaalsContact O-N 3.1Å; P298-A301 HydrophobicContact CG-CB 4.33Å; P298-A301 PolarHBondContact O-N 3.07Å; P298-A301 VanDerWaalsContact O-N 3.1Å; P298-R302 PolarHBondContact O-N 3.45Å
299	P	95.3	Very high	95.1	Very high	16 Å²	16	18.3 Å²	18.3	10%	0.104	9%	0.092	C	C	.	.	H	α-helix	trans	-59.5	-25	178.6	25.7	-35.3	0	0	0	113.1	A90 R302 A303 E340 V341 L344	A90-P299 HydrophobicContact CB-CG 4.24Å; P299-R302 PolarHBondContact O-N 3.49Å; P299-A303 WeakPolarHBondContact O-CB 3.45Å; P299-A303 PolarHBondContact O-N 3.39Å; P299-E340 HydrophobicContact CB-CB 3.78Å; P299-E340 HydrophobicContact CG-CB 4.33Å; P299-V341 HydrophobicContact CB-CG2 3.96Å; P299-V341 HydrophobicContact CG-CG2 4.41Å; P299-L344 HydrophobicContact CG-CD1 4Å
300	G	95.5	Very high	95.3	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.01	9%	0.092	C	C	.	.	H	α-helix	trans	-58.9	-48.7	172.8	0	0	0	0	0	113.3	P298 A303 R304	P298-G300 PolarHBondContact O-N 3.48Å; P298-G300 VanDerWaalsContact O-N 3.1Å; G300-A303 PolarHBondContact O-N 3.25Å; G300-R304 WeakPolarHBondContact O-CG 3.34Å; G300-R304 PolarHBondContact O-N 2.9Å
301	A	95.5	Very high	95.4	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.4	-49.8	176.9	0	0	0	0	0	111.5	M134 V168 E297 P298 A303 R304 V305	M134-A301 WeakPolarHBondContact O-CB 3.11Å; V168-A301 HydrophobicContact CB-CB 4.41Å; V168-A301 HydrophobicContact CG1-CB 3.92Å; E297-A301 HydrophobicContact CB-CB 4.02Å; P298-A301 HydrophobicContact CG-CB 4.33Å; P298-A301 PolarHBondContact O-N 3.07Å; P298-A301 VanDerWaalsContact O-N 3.1Å; A301-A303 VanDerWaalsContact C-N 3.27Å; A301-A303 PolarHBondContact O-N 3.25Å; A301-R304 PolarHBondContact O-N 2.84Å; A301-V305 WeakPolarHBondContact O-CB 3.43Å; A301-V305 PolarHBondContact O-N 2.86Å
302	R	95.6	Very high	95.4	Very high	24 Å²	24	18.3 Å²	18.3	9%	0.091	9%	0.092	C	C	.	.	H	α-helix	trans	-62.2	-32.7	179.1	-66.7	-174.9	-78	128.4	-3.7	112.5	V257 E297 P298 P299 R304 A337 E340	V257-R302 VanDerWaalsContact CG1-O 3.24Å; V257-R302 WeakPolarHBondContact CG1-O 3.39Å; E297-R302 PolarHBondContact O-NE 3.31Å; P298-R302 PolarHBondContact O-N 3.45Å; P299-R302 PolarHBondContact O-N 3.49Å; R302-R304 VanDerWaalsContact C-N 3.29Å; R302-R304 PolarHBondContact O-N 3.22Å; R302-A337 HydrophobicContact CB-CB 3.51Å; R302-E340 IonicContact CZ-OE1 3.93Å; R302-E340 IonicContact CZ-OE2 3.89Å; R302-E340 IonicContact NH1-OE1 3.54Å; R302-E340 PolarHBondContact NH1-OE1 2.98Å; R302-E340 IonicContact NH1-OE2 2.78Å; R302-E340 IonicContact NH2-OE1 3.07Å; R302-E340 PolarHBondContact NH2-OE1 3.46Å; R302-E340 IonicContact NH2-OE2 3.44Å; R302-E340 PolarHBondContact NH2-OE2 3.33Å
303	A	95.4	Very high	95.4	Very high	1 Å²	1	18 Å²	18	1%	0.008	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-10.2	177.2	0	0	0	0	0	113.8	P299 G300 A301 F334 A337 V341	P299-A303 WeakPolarHBondContact O-CB 3.45Å; P299-A303 PolarHBondContact O-N 3.39Å; G300-A303 PolarHBondContact O-N 3.25Å; A301-A303 VanDerWaalsContact C-N 3.27Å; A301-A303 PolarHBondContact O-N 3.25Å; A303-F334 WeakPolarHBondContact O-CE2 3.35Å; A303-A337 HydrophobicContact CB-CB 4.04Å; A303-V341 HydrophobicContact CB-CG2 4.13Å
304	R	96.4	Very high	95.5	Very high	31 Å²	31	18 Å²	18	12%	0.117	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-26.3	-176.4	-66.4	-63	176.6	-91.9	-1.5	114.3	E119 M134 V168 I187 G300 A301 R302 G306 L307 T308	E119-R304 IonicContact OE1-CZ 3.96Å; E119-R304 IonicContact OE1-NE 2.97Å; E119-R304 PolarHBondContact OE1-NE 2.8Å; E119-R304 IonicContact OE1-NH2 3.98Å; E119-R304 PolarHBondContact OE1-NH2 2.78Å; E119-R304 IonicContact OE2-NE 3.78Å; E119-R304 PolarHBondContact OE2-NE 2.91Å; M134-R304 HydrophobicContact CE-CG 4.28Å; M134-R304 HydrophobicContact SD-CB 4.29Å; M134-R304 HydrophobicContact SD-CG 4Å; V168-R304 HydrophobicContact CG2-CB 3.55Å; I187-R304 HydrophobicContact CD1-CB 4.2Å; I187-R304 HydrophobicContact CD1-CG 4.45Å; G300-R304 WeakPolarHBondContact O-CG 3.34Å; G300-R304 PolarHBondContact O-N 2.9Å; A301-R304 PolarHBondContact O-N 2.84Å; R302-R304 VanDerWaalsContact C-N 3.29Å; R302-R304 PolarHBondContact O-N 3.22Å; R304-G306 PolarHBondContact O-N 2.8Å; R304-G306 VanDerWaalsContact O-N 3.1Å; R304-L307 WeakPolarHBondContact O-CA 3.25Å; R304-L307 WeakPolarHBondContact O-CB 3.09Å; R304-L307 PolarHBondContact O-N 2.75Å; R304-T308 PolarHBondContact O-N 3.35Å; R304-T308 VanDerWaalsContact O-N 3.14Å
305	V	96.2	Very high	95.5	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-52.9	-36.3	-178.5	63.2	0	0	0	0	113.4	V168 V257 V291 G293 A301 L307 T308 G309	V168-V305 HydrophobicContact CG2-CB 4.49Å; V257-V305 HydrophobicContact CB-CG1 4.04Å; V257-V305 HydrophobicContact CG1-CG1 3.72Å; V257-V305 HydrophobicContact CG2-CG1 3.89Å; V291-V305 HydrophobicContact CB-CG2 4.4Å; V291-V305 HydrophobicContact CG1-CG2 3.6Å; G293-V305 VanDerWaalsContact N-CG2 3.27Å; A301-V305 WeakPolarHBondContact O-CB 3.43Å; A301-V305 PolarHBondContact O-N 2.86Å; V305-L307 VanDerWaalsContact C-N 3.31Å; V305-L307 PolarHBondContact O-N 2.85Å; V305-T308 WeakPolarHBondContact O-CB 3.44Å; V305-T308 PolarHBondContact O-N 3.25Å; V305-G309 PolarHBondContact O-N 3.26Å
306	G	95.9	Very high	95.7	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-60.7	-39.1	175.2	0	0	0	0	0	113	R304 L310	R304-G306 PolarHBondContact O-N 2.8Å; R304-G306 VanDerWaalsContact O-N 3.1Å; G306-L310 WeakPolarHBondContact O-CB 3.48Å; G306-L310 PolarHBondContact O-N 2.95Å
307	L	97	Very high	95.8	Very high	14 Å²	14	7.9 Å²	7.9	7%	0.073	4%	0.038	C	C	.	.	H	α-helix	trans	-70.4	-36.8	175.8	-59	170.5	0	0	0	111.4	I187 R304 V305 L310 T311 L365	I187-L307 HydrophobicContact CB-CB 4.35Å; R304-L307 WeakPolarHBondContact O-CA 3.25Å; R304-L307 WeakPolarHBondContact O-CB 3.09Å; R304-L307 PolarHBondContact O-N 2.75Å; V305-L307 VanDerWaalsContact C-N 3.31Å; V305-L307 PolarHBondContact O-N 2.85Å; L307-L310 PolarHBondContact O-N 3.14Å; L307-T311 WeakPolarHBondContact O-CB 3.47Å; L307-T311 PolarHBondContact O-N 3.44Å; L307-T311 PolarHBondContact O-OG1 3.01Å; L307-L365 HydrophobicContact CD2-CB 4.25Å; L307-L365 HydrophobicContact CD2-CD1 3.63Å; L307-L365 HydrophobicContact CG-CD1 4.3Å
308	T	97	Very high	95.7	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-60.7	-50.9	174.3	-58.2	0	0	0	0	111	V155 V168 V291 R304 V305 L310 T311 V312	V155-T308 HydrophobicContact CB-CG2 4.19Å; V155-T308 HydrophobicContact CG1-CG2 3.61Å; V155-T308 HydrophobicContact CG2-CG2 4.28Å; V168-T308 PolarHBondContact O-OG1 3.44Å; V291-T308 HydrophobicContact CG1-CG2 3.62Å; V291-T308 HydrophobicContact CG2-CG2 4.46Å; R304-T308 PolarHBondContact O-N 3.35Å; R304-T308 VanDerWaalsContact O-N 3.14Å; V305-T308 WeakPolarHBondContact O-CB 3.44Å; V305-T308 PolarHBondContact O-N 3.25Å; T308-L310 VanDerWaalsContact C-N 3.34Å; T308-L310 PolarHBondContact O-N 2.83Å; T308-T311 PolarHBondContact O-N 3.07Å; T308-V312 WeakPolarHBondContact O-CG2 3.45Å; T308-V312 PolarHBondContact O-N 3.28Å; T308-V312 VanDerWaalsContact O-N 3.15Å
309	G	96.6	Very high	95.6	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-59.8	-42.9	175.5	0	0	0	0	0	112.7	V253 V305 T311 V312 A313	V253-G309 WeakPolarHBondContact CG1-O 3.45Å; V305-G309 PolarHBondContact O-N 3.26Å; G309-T311 VanDerWaalsContact C-N 3.34Å; G309-T311 PolarHBondContact O-N 3.43Å; G309-V312 PolarHBondContact O-N 3.47Å; G309-A313 PolarHBondContact O-N 3.34Å; G309-A313 VanDerWaalsContact O-N 3.08Å
310	L	97.1	Very high	95.4	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-62.1	-40.8	175.8	-179.1	54.7	0	0	0	112.4	G306 L307 T308 V312 A313 E314 L326 L365 R368 I369 I377	G306-L310 WeakPolarHBondContact O-CB 3.48Å; G306-L310 PolarHBondContact O-N 2.95Å; L307-L310 PolarHBondContact O-N 3.14Å; T308-L310 VanDerWaalsContact C-N 3.34Å; T308-L310 PolarHBondContact O-N 2.83Å; L310-V312 VanDerWaalsContact C-N 3.31Å; L310-V312 PolarHBondContact O-N 3.2Å; L310-A313 CarbonylContact O-C 3.44Å; L310-A313 WeakPolarHBondContact O-CA 3.34Å; L310-A313 WeakPolarHBondContact O-CB 3.46Å; L310-A313 PolarHBondContact O-N 3.47Å; L310-A313 VanDerWaalsContact O-N 3.09Å; L310-E314 HydrophobicContact CD1-CG 4.15Å; L310-E314 HydrophobicContact CG-CG 4.29Å; L310-E314 VanDerWaalsContact O-CG 3.27Å; L310-E314 WeakPolarHBondContact O-CG 3.23Å; L310-E314 PolarHBondContact O-N 3.43Å; L310-L326 HydrophobicContact CB-CD2 4.25Å; L310-L326 HydrophobicContact CD1-CD2 3.72Å; L310-L365 HydrophobicContact CB-CD1 4.24Å; L310-L365 HydrophobicContact CD2-CD1 3.66Å; L310-L365 HydrophobicContact CD2-CG 4.36Å; L310-L365 WeakPolarHBondContact CD2-O 3.42Å; L310-R368 HydrophobicContact CD2-CB 3.54Å; L310-R368 HydrophobicContact CD2-CG 4.38Å; L310-R368 HydrophobicContact CG-CB 4.35Å; L310-I369 HydrophobicContact CD1-CG1 3.82Å; L310-I369 HydrophobicContact CD2-CG1 4.24Å; L310-I377 HydrophobicContact CD1-CD1 3.96Å; L310-I377 HydrophobicContact CD1-CG2 4.44Å
311	T	97	Very high	95.2	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.5	-37.6	179.5	-58.3	0	0	0	0	112.1	V155 V157 L185 P186 I187 L307 T308 G309 E314 H315 R368	V155-T311 HydrophobicContact CG2-CG2 3.98Å; V157-T311 HydrophobicContact CG1-CG2 4.39Å; L185-T311 HydrophobicContact CB-CG2 3.57Å; L185-T311 HydrophobicContact CD1-CG2 4.39Å; P186-T311 WeakPolarHBondContact O-CG2 3.26Å; I187-T311 WeakPolarHBondContact CA-OG1 3.27Å; I187-T311 PolarHBondContact O-OG1 3.26Å; L307-T311 WeakPolarHBondContact O-CB 3.47Å; L307-T311 PolarHBondContact O-N 3.44Å; L307-T311 PolarHBondContact O-OG1 3.01Å; T308-T311 PolarHBondContact O-N 3.07Å; G309-T311 VanDerWaalsContact C-N 3.34Å; G309-T311 PolarHBondContact O-N 3.43Å; T311-E314 PolarHBondContact O-N 3.3Å; T311-H315 PolarHBondContact O-N 2.85Å; T311-R368 PolarHBondContact OG1-NH2 3.07Å
312	V	96.2	Very high	94.9	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64.1	-44	172.3	177.2	0	0	0	0	110.5	V157 M166 V253 A289 T308 G309 L310 H315 F316	V157-V312 HydrophobicContact CG1-CG2 4.31Å; M166-V312 HydrophobicContact CE-CG2 3.89Å; M166-V312 HydrophobicContact SD-CG2 3.98Å; V253-V312 HydrophobicContact CG1-CB 4.35Å; V253-V312 HydrophobicContact CG1-CG1 4.4Å; V253-V312 HydrophobicContact CG2-CB 4.48Å; V253-V312 HydrophobicContact CG2-CG1 3.99Å; A289-V312 HydrophobicContact CB-CG1 4.2Å; T308-V312 WeakPolarHBondContact O-CG2 3.45Å; T308-V312 PolarHBondContact O-N 3.28Å; T308-V312 VanDerWaalsContact O-N 3.15Å; G309-V312 PolarHBondContact O-N 3.47Å; L310-V312 VanDerWaalsContact C-N 3.31Å; L310-V312 PolarHBondContact O-N 3.2Å; V312-H315 PolarHBondContact O-N 3.07Å; V312-F316 HydrophobicContact CG1-CD2 4.44Å; V312-F316 HydrophobicContact CG1-CE2 3.86Å; V312-F316 VanDerWaalsContact O-CD2 3.27Å; V312-F316 WeakPolarHBondContact O-CD2 3.42Å
313	A	96.1	Very high	94.7	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-64.1	-40.5	177.6	0	0	0	0	0	112.5	V253 G309 L310 H315 F316 R317 V324 L326 I377	V253-A313 HydrophobicContact CB-CB 4.29Å; V253-A313 HydrophobicContact CG2-CB 3.94Å; G309-A313 PolarHBondContact O-N 3.34Å; G309-A313 VanDerWaalsContact O-N 3.08Å; L310-A313 CarbonylContact O-C 3.44Å; L310-A313 WeakPolarHBondContact O-CA 3.34Å; L310-A313 WeakPolarHBondContact O-CB 3.46Å; L310-A313 PolarHBondContact O-N 3.47Å; L310-A313 VanDerWaalsContact O-N 3.09Å; A313-H315 VanDerWaalsContact C-N 3.29Å; A313-H315 PolarHBondContact O-N 2.81Å; A313-F316 PolarHBondContact O-N 3.29Å; A313-R317 PolarHBondContact O-N 3.49Å; A313-V324 HydrophobicContact CB-CG1 3.84Å; A313-L326 HydrophobicContact CB-CD1 4.45Å; A313-I377 HydrophobicContact CB-CD1 4.16Å; A313-I377 HydrophobicContact CB-CG1 4.37Å; A313-I377 HydrophobicContact CB-CG2 4.45Å
314	E	96	Very high	94.7	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-63.5	-33.5	177.3	-70.5	173.6	154.2	0	0	112.7	R189 L310 T311 F316 R317 D318 R368 I377	R189-E314 WeakPolarHBondContact CD-OE2 3.34Å; R189-E314 IonicContact CZ-OE2 2.71Å; R189-E314 IonicContact NE-OE2 3.94Å; R189-E314 IonicContact NH1-OE2 3.6Å; R189-E314 PolarHBondContact NH1-OE2 2.62Å; L310-E314 HydrophobicContact CD1-CG 4.15Å; L310-E314 HydrophobicContact CG-CG 4.29Å; L310-E314 VanDerWaalsContact O-CG 3.27Å; L310-E314 WeakPolarHBondContact O-CG 3.23Å; L310-E314 PolarHBondContact O-N 3.43Å; T311-E314 PolarHBondContact O-N 3.3Å; E314-F316 VanDerWaalsContact C-N 3.34Å; E314-F316 PolarHBondContact O-N 3.3Å; E314-R317 PolarHBondContact O-N 3.32Å; E314-D318 VanDerWaalsContact O-CB 3.23Å; E314-D318 WeakPolarHBondContact O-CB 3.36Å; E314-D318 PolarHBondContact O-N 3.24Å; E314-R368 VanDerWaalsContact CD-NH2 3.25Å; E314-R368 IonicContact OE1-CZ 3.73Å; E314-R368 IonicContact OE1-NE 3.67Å; E314-R368 PolarHBondContact OE1-NE 3.39Å; E314-R368 IonicContact OE1-NH2 2.76Å; E314-R368 PolarHBondContact OE1-NH2 3.26Å; E314-R368 IonicContact OE2-CZ 3.41Å; E314-R368 IonicContact OE2-NE 2.76Å; E314-R368 IonicContact OE2-NH2 3.27Å; E314-R368 PolarHBondContact OE2-NH2 2.76Å; E314-I377 HydrophobicContact CB-CD1 4.38Å; E314-I377 HydrophobicContact CG-CD1 3.73Å
315	H	95.2	Very high	94.6	Very high	23 Å²	23	16 Å²	16	11%	0.106	10%	0.097	C	C	.	.	H	α-helix	trans	-61.1	-45	174.2	-177.6	83.1	0	0	0	111.4	V157 G158 L185 T311 V312 A313 R317 A319 E320	V157-H315 HydrophobicContact CB-CB 3.75Å; V157-H315 HydrophobicContact CG1-CB 4.31Å; V157-H315 HydrophobicContact CG2-CB 3.97Å; V157-H315 WeakPolarHBondContact CG2-ND1 3.42Å; G158-H315 WeakPolarHBondContact CA-CD2 3.44Å; G158-H315 WeakPolarHBondContact CA-NE2 3.12Å; G158-H315 PolarHBondContact N-CD2 3.14Å; L185-H315 HydrophobicContact CD1-CB 3.97Å; T311-H315 PolarHBondContact O-N 2.85Å; V312-H315 PolarHBondContact O-N 3.07Å; A313-H315 VanDerWaalsContact C-N 3.29Å; A313-H315 PolarHBondContact O-N 2.81Å; H315-R317 VanDerWaalsContact C-N 3.32Å; H315-R317 PolarHBondContact O-N 2.86Å; H315-A319 WeakPolarHBondContact O-CA 3.47Å; H315-A319 VanDerWaalsContact O-CB 3.22Å; H315-A319 WeakPolarHBondContact O-CB 3.32Å; H315-A319 PolarHBondContact O-N 2.78Å; H315-E320 PolarHBondContact O-N 3.5Å
316	F	94.2	Very high	94.6	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-64.8	-36.1	176.8	-66.7	-59.9	0	0	0	112.2	R159 L162 F251 V253 V312 A313 E314 E320 G321 Q322 V324	R159-F316 HydrophobicContact CG-CE1 4.21Å; L162-F316 HydrophobicContact CD1-CE1 4.49Å; L162-F316 HydrophobicContact CD1-CZ 4.37Å; L162-F316 HydrophobicContact CD2-CE2 4.25Å; L162-F316 HydrophobicContact CD2-CZ 3.82Å; L162-F316 HydrophobicContact CG-CZ 3.99Å; F251-F316 HydrophobicContact CB-CD2 4.44Å; F251-F316 HydrophobicContact CB-CG 4.45Å; F251-F316 HydrophobicContact CD2-CB 4.44Å; F251-F316 AromaticContact CD2-CD1 3.71Å; F251-F316 HydrophobicContact CD2-CD1 3.71Å; F251-F316 HydrophobicContact CD2-CE1 4.14Å; F251-F316 HydrophobicContact CD2-CG 4.1Å; F251-F316 HydrophobicContact CE2-CD1 4.08Å; F251-F316 HydrophobicContact CE2-CE1 4.34Å; F251-F316 HydrophobicContact CG-CD1 4.32Å; F251-F316 HydrophobicContact CG-CE1 4.46Å; V253-F316 HydrophobicContact CG2-CD2 4.34Å; V253-F316 HydrophobicContact CG2-CE2 4.38Å; V312-F316 HydrophobicContact CG1-CD2 4.44Å; V312-F316 HydrophobicContact CG1-CE2 3.86Å; V312-F316 VanDerWaalsContact O-CD2 3.27Å; V312-F316 WeakPolarHBondContact O-CD2 3.42Å; A313-F316 PolarHBondContact O-N 3.29Å; E314-F316 VanDerWaalsContact C-N 3.34Å; E314-F316 PolarHBondContact O-N 3.3Å; F316-E320 HydrophobicContact CD1-CG 4.49Å; F316-E320 CarbonylContact O-C 3.59Å; F316-E320 WeakPolarHBondContact O-CB 3.38Å; F316-E320 PolarHBondContact O-N 3.27Å; F316-G321 PolarHBondContact O-N 3.19Å; F316-Q322 PolarHBondContact O-N 3.49Å; F316-V324 HydrophobicContact CB-CG2 3.48Å; F316-V324 VanDerWaalsContact CB-CG2 3.48Å
317	R	93.7	Very high	94.5	Very high	2 Å²	2	16 Å²	16	1%	0.008	10%	0.097	C	C	.	.	H	α-helix	trans	-68.3	-52.3	174.1	-173.1	-167.5	59.5	-155.9	-7.5	112.7	A313 E314 H315 G321 R368 T370 G375 I377	A313-R317 PolarHBondContact O-N 3.49Å; E314-R317 PolarHBondContact O-N 3.32Å; H315-R317 VanDerWaalsContact C-N 3.32Å; H315-R317 PolarHBondContact O-N 2.86Å; R317-G321 VanDerWaalsContact O-CA 3.28Å; R317-G321 WeakPolarHBondContact O-CA 3.42Å; R317-G321 PolarHBondContact O-N 3.19Å; R317-R368 PolarHBondContact NH1-O 3.28Å; R317-T370 PolarHBondContact NH1-O 3.39Å; R317-G375 WeakPolarHBondContact CG-O 3.13Å; R317-I377 HydrophobicContact CB-CD1 4.22Å; R317-I377 HydrophobicContact CB-CG1 4.01Å; R317-I377 HydrophobicContact CG-CG1 4.34Å
318	D	93.6	Very high	94.4	Very high	36 Å²	36	15.4 Å²	15.4	19%	0.193	9%	0.094	C	C	.	.	H	α-helix	trans	-85.8	-37.5	-165.4	-61.2	-18	0	0	0	112.8	R189 E314 K374	R189-D318 IonicContact CZ-OD2 2.73Å; R189-D318 IonicContact NH1-OD2 3.62Å; R189-D318 IonicContact NH2-OD2 3.43Å; R189-D318 PolarHBondContact NH2-OD2 3.43Å; E314-D318 VanDerWaalsContact O-CB 3.23Å; E314-D318 WeakPolarHBondContact O-CB 3.36Å; E314-D318 PolarHBondContact O-N 3.24Å; D318-K374 VanDerWaalsContact O-CD 3.26Å; D318-K374 WeakPolarHBondContact O-CD 3.41Å; D318-K374 PolarHBondContact O-NZ 3.36Å
319	A	92.1	Very high	94.2	Very high	69 Å²	69	16.3 Å²	16.3	57%	0.57	10%	0.099	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-42	-177.2	0	0	0	0	0	112.5	H315	H315-A319 WeakPolarHBondContact O-CA 3.47Å; H315-A319 VanDerWaalsContact O-CB 3.22Å; H315-A319 WeakPolarHBondContact O-CB 3.32Å; H315-A319 PolarHBondContact O-N 2.78Å
320	E	90.7	Very high	93.9	Very high	49 Å²	49	16.9 Å²	16.9	23%	0.229	10%	0.102	C	C	.	.	S	Bend	trans	-95	-10.9	179.7	-61.7	-165.2	-152.3	0	0	114.1	R159 H315 F316 Q322	R159-E320 VanDerWaalsContact CG-OE1 3.27Å; R159-E320 WeakPolarHBondContact CG-OE1 3.38Å; R159-E320 IonicContact CZ-OE2 3.96Å; R159-E320 VanDerWaalsContact CZ-OE2 3.3Å; R159-E320 IonicContact NE-OE1 3.53Å; R159-E320 PolarHBondContact NE-OE1 3.5Å; R159-E320 IonicContact NE-OE2 2.86Å; R159-E320 PolarHBondContact NE-OE2 3.47Å; R159-E320 IonicContact NH2-OE2 2.95Å; R159-E320 PolarHBondContact NH2-OE2 3.42Å; H315-E320 PolarHBondContact O-N 3.5Å; F316-E320 HydrophobicContact CD1-CG 4.49Å; F316-E320 CarbonylContact O-C 3.59Å; F316-E320 WeakPolarHBondContact O-CB 3.38Å; F316-E320 PolarHBondContact O-N 3.27Å; E320-Q322 VanDerWaalsContact C-N 3.31Å; E320-Q322 HydrophobicContact CB-CG 3.89Å; E320-Q322 PolarHBondContact O-N 2.98Å; E320-Q322 PolarHBondContact O-NE2 2.97Å
321	G	90.9	Very high	93.7	Very high	29 Å²	29	16.9 Å²	16.9	30%	0.299	10%	0.102	S	C	.	.			trans	63	36.2	179.9	0	0	0	0	0	113.2	F316 R317 K374	F316-G321 PolarHBondContact O-N 3.19Å; R317-G321 VanDerWaalsContact O-CA 3.28Å; R317-G321 WeakPolarHBondContact O-CA 3.42Å; R317-G321 PolarHBondContact O-N 3.19Å; G321-K374 CarbonylContact C-O 2.89Å; G321-K374 VanDerWaalsContact C-O 3.28Å; G321-K374 VanDerWaalsContact CA-O 3.25Å; G321-K374 WeakPolarHBondContact CA-O 3.49Å; G321-K374 VanDerWaalsContact O-O 3.08Å
322	Q	90	Very high	93.5	Very high	63 Å²	63	17.8 Å²	17.8	29%	0.294	11%	0.106	S	C	.	.			trans	-102.1	155.5	-177.5	-62.8	-62.1	-53.5	0	0	111.8	F251 F316 E320	F251-Q322 HydrophobicContact CD2-CB 4.4Å; F251-Q322 HydrophobicContact CD2-CG 4.23Å; F251-Q322 HydrophobicContact CE2-CG 4.16Å; F316-Q322 PolarHBondContact O-N 3.49Å; E320-Q322 VanDerWaalsContact C-N 3.31Å; E320-Q322 HydrophobicContact CB-CG 3.89Å; E320-Q322 PolarHBondContact O-N 2.98Å; E320-Q322 PolarHBondContact O-NE2 2.97Å
323	D	92.2	Very high	93.3	Very high	41 Å²	41	20.7 Å²	20.7	22%	0.219	12%	0.117	C	C	.	.			trans	-81.9	127.3	163.4	-65.7	-46.7	0	0	0	109.6	R219 G250 F251 S376	R219-D323 IonicContact CZ-OD1 3.16Å; R219-D323 IonicContact CZ-OD2 3.53Å; R219-D323 VanDerWaalsContact CZ-OD2 3.27Å; R219-D323 IonicContact NE-OD1 3.49Å; R219-D323 PolarHBondContact NE-OD1 3.32Å; R219-D323 IonicContact NE-OD2 3.21Å; R219-D323 PolarHBondContact NE-OD2 2.85Å; R219-D323 IonicContact NH2-OD1 2.7Å; R219-D323 PolarHBondContact NH2-OD1 3.27Å; R219-D323 IonicContact NH2-OD2 3.01Å; R219-D323 PolarHBondContact NH2-OD2 2.92Å; G250-D323 VanDerWaalsContact CA-O 3.25Å; G250-D323 WeakPolarHBondContact CA-O 3.45Å; F251-D323 PolarHBondContact N-O 3.2Å; D323-S376 WeakPolarHBondContact CA-O 3.37Å; D323-S376 WeakPolarHBondContact OD1-CB 3.37Å; D323-S376 PolarHBondContact OD1-N 2.86Å; D323-S376 PolarHBondContact OD1-OG 3.02Å
324	V	93.9	Very high	93.3	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.006	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	135.3	-172.4	-172.5	0	0	0	0	109.5	F251 V253 A313 F316 S376 I377 T378	F251-V324 CarbonylContact O-C 3.52Å; F251-V324 VanDerWaalsContact O-CA 3.27Å; F251-V324 WeakPolarHBondContact O-CA 3.44Å; F251-V324 WeakPolarHBondContact O-CG1 3.5Å; V253-V324 HydrophobicContact CG2-CG1 4.21Å; A313-V324 HydrophobicContact CB-CG1 3.84Å; F316-V324 HydrophobicContact CB-CG2 3.48Å; F316-V324 VanDerWaalsContact CB-CG2 3.48Å; V324-S376 PolarHBondContact N-O 3.05Å; V324-I377 HydrophobicContact CB-CG1 4.38Å; V324-I377 WeakPolarHBondContact O-CA 3.3Å; V324-T378 PolarHBondContact O-N 3.33Å
325	L	94.3	Very high	93.2	Very high	7 Å²	7	20.9 Å²	20.9	4%	0.037	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	122.8	166.8	-66.8	-172.5	0	0	0	110.6	L204 V244 F251 S252 V253 F327 T378	L204-L325 HydrophobicContact CD2-CD2 3.77Å; V244-L325 HydrophobicContact CB-CD1 3.66Å; V244-L325 HydrophobicContact CB-CG 4.38Å; V244-L325 HydrophobicContact CG1-CD1 3.81Å; V244-L325 HydrophobicContact CG1-CD2 4.39Å; V244-L325 HydrophobicContact CG1-CG 3.96Å; V244-L325 HydrophobicContact CG2-CD1 3.84Å; F251-L325 PolarHBondContact O-N 3.26Å; S252-L325 CarbonylContact C-O 3.53Å; S252-L325 VanDerWaalsContact CA-O 3.25Å; S252-L325 WeakPolarHBondContact CA-O 3.35Å; V253-L325 PolarHBondContact N-O 3.1Å; L325-F327 HydrophobicContact CB-CD2 4.4Å; L325-F327 HydrophobicContact CB-CE2 3.61Å; L325-F327 HydrophobicContact CB-CZ 4.16Å; L325-F327 HydrophobicContact CD1-CE2 4.07Å; L325-F327 HydrophobicContact CD1-CZ 3.92Å; L325-T378 CarbonylContact C-O 3.56Å; L325-T378 WeakPolarHBondContact CA-O 3.37Å; L325-T378 HydrophobicContact CD2-CG2 4.29Å
326	L	96.2	Very high	93.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118.3	173.7	177.4	64.3	0	0	0	110	V253 L310 A313 I328 I369 I377 T378 S379 V380	V253-L326 HydrophobicContact CB-CD1 4.08Å; V253-L326 HydrophobicContact CG1-CD1 4.19Å; V253-L326 CarbonylContact O-C 3.4Å; V253-L326 WeakPolarHBondContact O-CA 3.34Å; L310-L326 HydrophobicContact CB-CD2 4.25Å; L310-L326 HydrophobicContact CD1-CD2 3.72Å; A313-L326 HydrophobicContact CB-CD1 4.45Å; L326-I328 HydrophobicContact CD2-CD1 4.09Å; L326-I328 HydrophobicContact CD2-CG1 4.28Å; L326-I328 HydrophobicContact CG-CD1 4.41Å; L326-I328 HydrophobicContact CG-CG1 4.05Å; L326-I369 HydrophobicContact CD2-CD1 4Å; L326-I369 HydrophobicContact CD2-CG1 4.15Å; L326-I377 HydrophobicContact CB-CG2 3.73Å; L326-I377 HydrophobicContact CD2-CG2 4.21Å; L326-T378 PolarHBondContact N-O 3.15Å; L326-S379 CarbonylContact O-C 3.6Å; L326-S379 WeakPolarHBondContact O-CA 3.45Å; L326-V380 PolarHBondContact O-N 2.74Å
327	F	95.2	Very high	93.1	Very high	1 Å²	1	22.7 Å²	22.7	0%	0.004	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	129.2	173.6	-64	-88.5	0	0	0	109.6	I237 L240 I241 V253 F254 A255 L325 V380	I237-F327 HydrophobicContact CB-CD1 4.18Å; I237-F327 HydrophobicContact CB-CE1 4.15Å; I237-F327 HydrophobicContact CD1-CD1 4.46Å; I237-F327 HydrophobicContact CG1-CD1 3.92Å; I237-F327 HydrophobicContact CG1-CE1 4.11Å; I237-F327 HydrophobicContact CG2-CD1 3.51Å; I237-F327 HydrophobicContact CG2-CE1 3.68Å; I237-F327 HydrophobicContact CG2-CG 3.99Å; I237-F327 HydrophobicContact CG2-CZ 4.31Å; L240-F327 HydrophobicContact CB-CE1 4.44Å; L240-F327 HydrophobicContact CB-CZ 4.18Å; L240-F327 HydrophobicContact CD1-CE1 4.45Å; I241-F327 HydrophobicContact CD1-CD2 4.09Å; I241-F327 HydrophobicContact CD1-CE2 3.77Å; I241-F327 HydrophobicContact CD1-CZ 4.18Å; I241-F327 HydrophobicContact CG1-CD2 4.05Å; I241-F327 HydrophobicContact CG1-CE1 4.49Å; I241-F327 HydrophobicContact CG1-CE2 3.23Å; I241-F327 HydrophobicContact CG1-CZ 3.5Å; I241-F327 VanDerWaalsContact CG1-CZ 3.5Å; V253-F327 PolarHBondContact O-N 2.87Å; F254-F327 HydrophobicContact CD2-CB 3.55Å; F254-F327 HydrophobicContact CD2-CG 4.3Å; F254-F327 HydrophobicContact CE2-CB 4.09Å; F254-F327 HydrophobicContact CG-CB 4.37Å; A255-F327 PolarHBondContact N-O 2.97Å; L325-F327 HydrophobicContact CB-CD2 4.4Å; L325-F327 HydrophobicContact CB-CE2 3.61Å; L325-F327 HydrophobicContact CB-CZ 4.16Å; L325-F327 HydrophobicContact CD1-CE2 4.07Å; L325-F327 HydrophobicContact CD1-CZ 3.92Å; F327-V380 WeakPolarHBondContact CA-O 3.46Å; F327-V380 HydrophobicContact CD1-CB 3.7Å; F327-V380 HydrophobicContact CD1-CG1 4.2Å; F327-V380 HydrophobicContact CD1-CG2 4.38Å; F327-V380 HydrophobicContact CE1-CB 3.72Å; F327-V380 HydrophobicContact CE1-CG1 4.2Å; F327-V380 HydrophobicContact CE1-CG2 3.93Å
328	I	95.1	Very high	93.2	Very high	2 Å²	2	23 Å²	23	1%	0.01	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	100.3	174.8	-52.4	-178	0	0	0	107.8	A255 V257 L326 I331 L365 I369 V380 Q381 A382	A255-I328 WeakPolarHBondContact O-CA 3.25Å; V257-I328 HydrophobicContact CG2-CG2 3.74Å; L326-I328 HydrophobicContact CD2-CD1 4.09Å; L326-I328 HydrophobicContact CD2-CG1 4.28Å; L326-I328 HydrophobicContact CG-CD1 4.41Å; L326-I328 HydrophobicContact CG-CG1 4.05Å; I328-I331 HydrophobicContact CD1-CD1 4.42Å; I328-I331 HydrophobicContact CG2-CB 4.22Å; I328-I331 HydrophobicContact CG2-CD1 4.16Å; I328-L365 HydrophobicContact CD1-CD2 4.14Å; I328-I369 HydrophobicContact CD1-CD1 4.36Å; I328-V380 PolarHBondContact N-O 3.27Å; I328-Q381 HydrophobicContact CB-CB 4.36Å; I328-Q381 HydrophobicContact CB-CG 4.15Å; I328-Q381 HydrophobicContact CD1-CG 4.2Å; I328-Q381 HydrophobicContact CG1-CG 4.3Å; I328-Q381 CarbonylContact O-C 3.54Å; I328-Q381 WeakPolarHBondContact O-CA 3.3Å; I328-A382 PolarHBondContact O-N 3.02Å
329	D	92.4	Very high	93.3	Very high	18 Å²	18	22.4 Å²	22.4	10%	0.096	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	103	172.9	-157.3	2	0	0	0	107.2	F254 A255 G256 V257 E259 A382	F254-D329 HydrophobicContact CE2-CB 4.24Å; F254-D329 HydrophobicContact CZ-CB 3.81Å; A255-D329 PolarHBondContact O-N 3.19Å; A255-D329 VanDerWaalsContact O-N 3.09Å; G256-D329 CarbonylContact C-O 3.57Å; G256-D329 VanDerWaalsContact CA-O 3.3Å; G256-D329 WeakPolarHBondContact CA-O 3.2Å; V257-D329 PolarHBondContact N-O 2.86Å; E259-D329 HydrophobicContact CG-CB 4.45Å; E259-D329 WeakPolarHBondContact CG-O 3.46Å; E259-D329 VanDerWaalsContact OE1-C 3.27Å; D329-A382 HydrophobicContact CB-CB 4.35Å; D329-A382 WeakPolarHBondContact OD1-CB 3.38Å
330	N	89.4	Confident	93.4	Very high	12 Å²	12	22.2 Å²	22.2	6%	0.064	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	cis	-125.1	137.3	3	-173.8	-57.1	0	0	0	111.2	V257 F332 R333 F334 A382 Y384	V257-N330 PolarHBondContact O-N 3.46Å; N330-F332 PolarHBondContact O-N 3.45Å; N330-F332 WeakPolarHBondContact OD1-CB 3.49Å; N330-F332 PolarHBondContact OD1-N 2.83Å; N330-R333 HydrophobicContact CB-CG 4.07Å; N330-R333 WeakPolarHBondContact O-CB 3.37Å; N330-R333 PolarHBondContact O-N 3.45Å; N330-F334 PolarHBondContact O-N 3.29Å; N330-A382 HydrophobicContact CB-CB 4.41Å; N330-A382 PolarHBondContact ND2-O 3.43Å; N330-A382 PolarHBondContact OD1-O 2.76Å; N330-Y384 PolarHBondContact ND2-N 3.05Å; N330-Y384 PolarHBondContact OD1-N 2.94Å
331	I	93.8	Very high	93.5	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-64	-28	-179	-169.4	64.6	0	0	0	112.6	I328 R333 F334 T335 L362 L365 Q381 A382 I383 T398	I328-I331 HydrophobicContact CD1-CD1 4.42Å; I328-I331 HydrophobicContact CG2-CB 4.22Å; I328-I331 HydrophobicContact CG2-CD1 4.16Å; I331-R333 VanDerWaalsContact C-N 3.27Å; I331-R333 PolarHBondContact O-N 3.03Å; I331-F334 HydrophobicContact CD1-CB 4.16Å; I331-F334 HydrophobicContact CD1-CD1 4.21Å; I331-F334 HydrophobicContact CD1-CG 4.37Å; I331-F334 VanDerWaalsContact O-CB 3.31Å; I331-F334 WeakPolarHBondContact O-CB 3.46Å; I331-F334 PolarHBondContact O-N 3.31Å; I331-T335 PolarHBondContact O-N 2.94Å; I331-L362 HydrophobicContact CD1-CD1 3.97Å; I331-L362 HydrophobicContact CG1-CD1 3.99Å; I331-L365 HydrophobicContact CD1-CD2 3.51Å; I331-Q381 HydrophobicContact CB-CB 4.27Å; I331-Q381 HydrophobicContact CG2-CB 4.2Å; I331-A382 WeakPolarHBondContact CG2-O 3.32Å; I331-A382 PolarHBondContact N-O 3.35Å; I331-I383 HydrophobicContact CG2-CB 4.47Å; I331-I383 HydrophobicContact CG2-CD1 4.48Å; I331-I383 HydrophobicContact CG2-CG1 3.51Å; I331-T398 HydrophobicContact CG2-CG2 4.03Å
332	F	92.1	Very high	93.7	Very high	20 Å²	20	19.1 Å²	19.1	9%	0.088	9%	0.093	C	C	.	.	H	α-helix	trans	-62.8	-34.8	172.7	-179.9	-98.1	0	0	0	111.9	N330 F334 T335 Q336 Y384 P386 A394	N330-F332 PolarHBondContact O-N 3.45Å; N330-F332 WeakPolarHBondContact OD1-CB 3.49Å; N330-F332 PolarHBondContact OD1-N 2.83Å; F332-F334 VanDerWaalsContact C-N 3.32Å; F332-F334 PolarHBondContact O-N 3.32Å; F332-T335 WeakPolarHBondContact O-CB 3.18Å; F332-T335 PolarHBondContact O-N 3.48Å; F332-Q336 WeakPolarHBondContact O-CB 3.36Å; F332-Q336 PolarHBondContact O-N 3.48Å; F332-Y384 AromaticContact CD1-CD1 3.64Å; F332-Y384 HydrophobicContact CD1-CD1 3.64Å; F332-Y384 HydrophobicContact CD1-CG 4.3Å; F332-Y384 WeakPolarHBondContact CD2-O 3.2Å; F332-Y384 AromaticContact CE1-CD1 3.66Å; F332-Y384 HydrophobicContact CE1-CD1 3.66Å; F332-Y384 HydrophobicContact CE1-CE1 4.19Å; F332-Y384 HydrophobicContact CG-CD1 4.15Å; F332-Y384 HydrophobicContact CZ-CD1 4.19Å; F332-P386 HydrophobicContact CE2-CG 4.12Å; F332-P386 HydrophobicContact CZ-CB 4.43Å; F332-P386 HydrophobicContact CZ-CG 4.33Å; F332-A394 HydrophobicContact CD2-CB 4.06Å; F332-A394 HydrophobicContact CE2-CB 3.89Å
333	R	92.3	Very high	93.8	Very high	60 Å²	60	19.6 Å²	19.6	23%	0.226	11%	0.108	C	C	.	.	H	α-helix	trans	-69.2	-30.9	177.2	-65.5	-63.3	-171.1	-164.3	-3.4	112.3	V257 N330 I331 Q336 A337	V257-R333 HydrophobicContact CB-CB 4.49Å; V257-R333 HydrophobicContact CG1-CB 4.17Å; V257-R333 WeakPolarHBondContact O-CB 3.33Å; V257-R333 WeakPolarHBondContact O-CG 3.45Å; N330-R333 HydrophobicContact CB-CG 4.07Å; N330-R333 WeakPolarHBondContact O-CB 3.37Å; N330-R333 PolarHBondContact O-N 3.45Å; I331-R333 VanDerWaalsContact C-N 3.27Å; I331-R333 PolarHBondContact O-N 3.03Å; R333-Q336 VanDerWaalsContact CD-OE1 3.28Å; R333-A337 VanDerWaalsContact O-CB 3.25Å; R333-A337 WeakPolarHBondContact O-CB 3.41Å; R333-A337 PolarHBondContact O-N 3.47Å
334	F	95.3	Very high	93.8	Very high	5 Å²	5	20.6 Å²	20.6	2%	0.022	11%	0.113	C	C	.	.	H	α-helix	trans	-60.6	-48.4	168.9	172.7	-96.5	0	0	0	110.6	V257 A303 N330 I331 F332 A337 N338 L362 L365	V257-F334 HydrophobicContact CG1-CB 3.99Å; A303-F334 WeakPolarHBondContact O-CE2 3.35Å; N330-F334 PolarHBondContact O-N 3.29Å; I331-F334 HydrophobicContact CD1-CB 4.16Å; I331-F334 HydrophobicContact CD1-CD1 4.21Å; I331-F334 HydrophobicContact CD1-CG 4.37Å; I331-F334 VanDerWaalsContact O-CB 3.31Å; I331-F334 WeakPolarHBondContact O-CB 3.46Å; I331-F334 PolarHBondContact O-N 3.31Å; F332-F334 VanDerWaalsContact C-N 3.32Å; F332-F334 PolarHBondContact O-N 3.32Å; F334-A337 PolarHBondContact O-N 3.21Å; F334-N338 WeakPolarHBondContact CE1-ND2 3.5Å; F334-N338 WeakPolarHBondContact CE2-ND2 3.49Å; F334-N338 VanDerWaalsContact CZ-ND2 3.3Å; F334-N338 WeakPolarHBondContact CZ-ND2 3.27Å; F334-N338 PolarHBondContact O-N 3Å; F334-N338 PolarHBondContact O-ND2 2.95Å; F334-L362 HydrophobicContact CD1-CD1 4.32Å; F334-L362 HydrophobicContact CE1-CD1 4.4Å; F334-L365 HydrophobicContact CD1-CD2 4.38Å; F334-L365 HydrophobicContact CE1-CD2 4.32Å; F334-L365 HydrophobicContact CE2-CD2 4.48Å; F334-L365 HydrophobicContact CZ-CB 4.38Å; F334-L365 HydrophobicContact CZ-CD2 4.36Å
335	T	94.3	Very high	93.7	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.006	11%	0.114	C	C	.	.	H	α-helix	trans	-61.9	-46	177.1	-63.8	0	0	0	0	112.1	I331 F332 A337 N338 S339 Y354 L358 A394	I331-T335 PolarHBondContact O-N 2.94Å; F332-T335 WeakPolarHBondContact O-CB 3.18Å; F332-T335 PolarHBondContact O-N 3.48Å; T335-A337 PolarHBondContact O-N 2.96Å; T335-N338 PolarHBondContact O-N 2.96Å; T335-S339 PolarHBondContact O-N 3.42Å; T335-Y354 HydrophobicContact CG2-CD1 4.04Å; T335-Y354 HydrophobicContact CG2-CE1 3.93Å; T335-L358 HydrophobicContact CG2-CD1 3.35Å; T335-A394 HydrophobicContact CG2-CB 3.68Å
336	Q	93.1	Very high	93.5	Very high	60 Å²	60	23.5 Å²	23.5	28%	0.28	14%	0.143	S	C	.	.	H	α-helix	trans	-59.4	-45.7	177.4	-173.2	-175.7	21.3	0	0	111.7	F332 R333 N338 S339 E340	F332-Q336 WeakPolarHBondContact O-CB 3.36Å; F332-Q336 PolarHBondContact O-N 3.48Å; R333-Q336 VanDerWaalsContact CD-OE1 3.28Å; Q336-N338 VanDerWaalsContact C-N 3.34Å; Q336-N338 PolarHBondContact O-N 2.76Å; Q336-S339 WeakPolarHBondContact O-CB 3.36Å; Q336-S339 PolarHBondContact O-N 3.3Å; Q336-S339 VanDerWaalsContact O-N 3.14Å; Q336-E340 WeakPolarHBondContact O-CG 3.31Å; Q336-E340 PolarHBondContact O-N 2.94Å
337	A	95	Very high	93.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.7	-41.6	178.1	0	0	0	0	0	111.8	R302 A303 R333 F334 T335 S339 E340 V341	R302-A337 HydrophobicContact CB-CB 3.51Å; A303-A337 HydrophobicContact CB-CB 4.04Å; R333-A337 VanDerWaalsContact O-CB 3.25Å; R333-A337 WeakPolarHBondContact O-CB 3.41Å; R333-A337 PolarHBondContact O-N 3.47Å; F334-A337 PolarHBondContact O-N 3.21Å; T335-A337 PolarHBondContact O-N 2.96Å; A337-S339 VanDerWaalsContact C-N 3.32Å; A337-S339 PolarHBondContact O-N 3.48Å; A337-E340 PolarHBondContact O-N 2.89Å; A337-V341 WeakPolarHBondContact O-CG2 3.27Å; A337-V341 PolarHBondContact O-N 2.88Å
338	N	95.5	Very high	93.3	Very high	9 Å²	9	34.4 Å²	34.4	5%	0.048	19%	0.193	C	C	.	.	H	α-helix	trans	-65.4	-34.6	174.4	-76.5	-66.9	0	0	0	112.6	F334 T335 Q336 V341 S342	F334-N338 WeakPolarHBondContact CE1-ND2 3.5Å; F334-N338 WeakPolarHBondContact CE2-ND2 3.49Å; F334-N338 VanDerWaalsContact CZ-ND2 3.3Å; F334-N338 WeakPolarHBondContact CZ-ND2 3.27Å; F334-N338 PolarHBondContact O-N 3Å; F334-N338 PolarHBondContact O-ND2 2.95Å; T335-N338 PolarHBondContact O-N 2.96Å; Q336-N338 VanDerWaalsContact C-N 3.34Å; Q336-N338 PolarHBondContact O-N 2.76Å; N338-V341 PolarHBondContact O-N 3.38Å; N338-S342 VanDerWaalsContact O-CB 3.22Å; N338-S342 WeakPolarHBondContact O-CB 3.22Å; N338-S342 PolarHBondContact O-N 2.85Å
339	S	94.7	Very high	93.2	Very high	24 Å²	24	38.2 Å²	38.2	17%	0.168	22%	0.219	C	C	.	.	H	α-helix	trans	-63.7	-43.1	172.6	-166.6	0	0	0	0	111.8	T335 Q336 A337 S342 A343 G353	T335-S339 PolarHBondContact O-N 3.42Å; Q336-S339 WeakPolarHBondContact O-CB 3.36Å; Q336-S339 PolarHBondContact O-N 3.3Å; Q336-S339 VanDerWaalsContact O-N 3.14Å; A337-S339 VanDerWaalsContact C-N 3.32Å; A337-S339 PolarHBondContact O-N 3.48Å; S339-S342 PolarHBondContact O-N 2.87Å; S339-A343 PolarHBondContact O-N 2.87Å; S339-G353 PolarHBondContact OG-O 3.12Å
340	E	94.1	Very high	93.2	Very high	65 Å²	65	40.8 Å²	40.8	30%	0.304	24%	0.238	S	C	.	.	H	α-helix	trans	-62.7	-47.6	174.8	-69.2	174	-130.6	0	0	111.5	P299 R302 Q336 A337 S342 A343 L344	P299-E340 HydrophobicContact CB-CB 3.78Å; P299-E340 HydrophobicContact CG-CB 4.33Å; R302-E340 IonicContact CZ-OE1 3.93Å; R302-E340 IonicContact CZ-OE2 3.89Å; R302-E340 IonicContact NH1-OE1 3.54Å; R302-E340 PolarHBondContact NH1-OE1 2.98Å; R302-E340 IonicContact NH1-OE2 2.78Å; R302-E340 IonicContact NH2-OE1 3.07Å; R302-E340 PolarHBondContact NH2-OE1 3.46Å; R302-E340 IonicContact NH2-OE2 3.44Å; R302-E340 PolarHBondContact NH2-OE2 3.33Å; Q336-E340 WeakPolarHBondContact O-CG 3.31Å; Q336-E340 PolarHBondContact O-N 2.94Å; A337-E340 PolarHBondContact O-N 2.89Å; E340-S342 VanDerWaalsContact C-N 3.32Å; E340-S342 PolarHBondContact O-N 2.78Å; E340-A343 PolarHBondContact O-N 3.27Å; E340-L344 WeakPolarHBondContact O-CG 3.32Å; E340-L344 PolarHBondContact O-N 2.85Å; E340-L344 VanDerWaalsContact O-N 3.07Å
341	V	94	Very high	93.1	Very high	8 Å²	8	42.9 Å²	42.9	5%	0.048	26%	0.257	C	S	.	.	H	α-helix	trans	-58.1	-45.5	175.3	168.9	0	0	0	0	110.8	I132 P299 A303 A337 N338 A343 L344 L345	I132-V341 HydrophobicContact CD1-CG1 3.35Å; I132-V341 HydrophobicContact CG1-CG1 4.01Å; I132-V341 HydrophobicContact CG2-CG2 4.38Å; P299-V341 HydrophobicContact CB-CG2 3.96Å; P299-V341 HydrophobicContact CG-CG2 4.41Å; A303-V341 HydrophobicContact CB-CG2 4.13Å; A337-V341 WeakPolarHBondContact O-CG2 3.27Å; A337-V341 PolarHBondContact O-N 2.88Å; N338-V341 PolarHBondContact O-N 3.38Å; V341-A343 VanDerWaalsContact C-N 3.33Å; V341-A343 PolarHBondContact O-N 2.85Å; V341-L344 PolarHBondContact O-N 3Å; V341-L345 HydrophobicContact CG1-CD1 3.97Å; V341-L345 HydrophobicContact CG1-CG 4.26Å; V341-L345 WeakPolarHBondContact O-CG 3.25Å; V341-L345 PolarHBondContact O-N 2.83Å
342	S	94.3	Very high	92.8	Very high	4 Å²	4	48.2 Å²	48.2	3%	0.028	29%	0.289	C	S	.	.	H	α-helix	trans	-61	-41	180	179.2	0	0	0	0	112.5	N338 S339 E340 L345 G346 R347 Q355	N338-S342 VanDerWaalsContact O-CB 3.22Å; N338-S342 WeakPolarHBondContact O-CB 3.22Å; N338-S342 PolarHBondContact O-N 2.85Å; S339-S342 PolarHBondContact O-N 2.87Å; E340-S342 VanDerWaalsContact C-N 3.32Å; E340-S342 PolarHBondContact O-N 2.78Å; S342-L345 PolarHBondContact O-N 2.67Å; S342-G346 PolarHBondContact O-N 3.1Å; S342-R347 PolarHBondContact O-N 3.32Å; S342-R347 VanDerWaalsContact O-N 3.14Å; S342-R347 WeakPolarHBondContact OG-CB 3.24Å; S342-R347 WeakPolarHBondContact OG-CD 3.37Å; S342-Q355 WeakPolarHBondContact OG-CB 3.5Å
343	A	92.6	Very high	92.8	Very high	73 Å²	73	49.2 Å²	49.2	60%	0.603	31%	0.305	S	S	*	.	H	α-helix	trans	-63.6	-43	175.1	0	0	0	0	0	111.5	S339 E340 V341 L345 G346	S339-A343 PolarHBondContact O-N 2.87Å; E340-A343 PolarHBondContact O-N 3.27Å; V341-A343 VanDerWaalsContact C-N 3.33Å; V341-A343 PolarHBondContact O-N 2.85Å; A343-L345 VanDerWaalsContact C-N 3.32Å; A343-L345 PolarHBondContact O-N 2.84Å; A343-G346 PolarHBondContact O-N 3.44Å; A343-G346 VanDerWaalsContact O-N 3.08Å
344	L	92	Very high	92.8	Very high	62 Å²	62	47.5 Å²	47.5	33%	0.325	30%	0.299	S	S	.	.	H	α-helix	trans	-65.9	-32.6	176.4	-66.9	173.5	0	0	0	113.1	A90 V91 P299 E340 V341 G346	A90-L344 HydrophobicContact CB-CD1 4.11Å; V91-L344 HydrophobicContact CG2-CB 3.58Å; V91-L344 HydrophobicContact CG2-CD1 4.48Å; P299-L344 HydrophobicContact CG-CD1 4Å; E340-L344 WeakPolarHBondContact O-CG 3.32Å; E340-L344 PolarHBondContact O-N 2.85Å; E340-L344 VanDerWaalsContact O-N 3.07Å; V341-L344 PolarHBondContact O-N 3Å; L344-G346 PolarHBondContact O-N 2.95Å
345	L	92.8	Very high	92.8	Very high	7 Å²	7	47.4 Å²	47.4	4%	0.037	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-12.6	173.9	-69	176.7	0	0	0	113	V91 A121 R130 I132 V341 S342 A343 R347	V91-L345 HydrophobicContact CG2-CD2 4.31Å; A121-L345 HydrophobicContact CB-CD1 4.27Å; A121-L345 HydrophobicContact CB-CD2 3.93Å; R130-L345 HydrophobicContact CG-CD2 3.8Å; R130-L345 PolarHBondContact NH1-O 3.36Å; I132-L345 HydrophobicContact CD1-CD1 4.4Å; I132-L345 HydrophobicContact CG1-CD2 4.31Å; V341-L345 HydrophobicContact CG1-CD1 3.97Å; V341-L345 HydrophobicContact CG1-CG 4.26Å; V341-L345 WeakPolarHBondContact O-CG 3.25Å; V341-L345 PolarHBondContact O-N 2.83Å; S342-L345 PolarHBondContact O-N 2.67Å; A343-L345 VanDerWaalsContact C-N 3.32Å; A343-L345 PolarHBondContact O-N 2.84Å; L345-R347 HydrophobicContact CB-CG 4.33Å
346	G	90.4	Very high	92.8	Very high	63 Å²	63	51 Å²	51	65%	0.649	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	21.6	-178.9	0	0	0	0	0	113.8	S342 A343 L344	S342-G346 PolarHBondContact O-N 3.1Å; A343-G346 PolarHBondContact O-N 3.44Å; A343-G346 VanDerWaalsContact O-N 3.08Å; L344-G346 PolarHBondContact O-N 2.95Å
347	R	91.2	Very high	92.8	Very high	86 Å²	86	49.8 Å²	49.8	33%	0.325	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-70.9	142.8	174.3	-64.1	177.4	179.7	175	1.3	109.6	S342 L345 P356 T357	S342-R347 PolarHBondContact O-N 3.32Å; S342-R347 VanDerWaalsContact O-N 3.14Å; S342-R347 WeakPolarHBondContact OG-CB 3.24Å; S342-R347 WeakPolarHBondContact OG-CD 3.37Å; L345-R347 HydrophobicContact CB-CG 4.33Å; R347-P356 HydrophobicContact CB-CG 4.4Å; R347-T357 PolarHBondContact NH1-OG1 3.07Å; R347-T357 VanDerWaalsContact NH1-OG1 3.11Å
348	I	94.2	Very high	92.8	Very high	143 Å²	143	50.4 Å²	50.4	73%	0.733	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-64.8	125.5	173.5	-61.2	175.2	0	0	0	108.1	P356	I348-P356 WeakPolarHBondContact O-CD 3.42Å
349	P	93.4	Very high	92.7	Very high	83 Å²	83	53 Å²	53	54%	0.539	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-66.4	148.6	176.7	27.7	-33.9	0	0	0	111.2
350	S	92.2	Very high	92.7	Very high	71 Å²	71	56.8 Å²	56.8	50%	0.497	37%	0.367	S	S	.	.			trans	-95.9	-159.7	175	-168.8	0	0	0	0	110.6	V352 G353 Y354	S350-V352 PolarHBondContact O-N 3.23Å; S350-G353 PolarHBondContact O-N 3.42Å; S350-G353 VanDerWaalsContact O-N 3.07Å; S350-Y354 WeakPolarHBondContact CB-O 3.09Å; S350-Y354 PolarHBondContact N-O 3.46Å
351	A	87.4	Confident	92.7	Very high	57 Å²	57	55.8 Å²	55.8	47%	0.471	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-47.4	133.2	177.8	0	0	0	0	0	112	G353 Y354 P393	A351-G353 PolarHBondContact O-N 2.88Å; A351-Y354 WeakPolarHBondContact O-CD2 3.42Å; A351-Y354 PolarHBondContact O-N 2.82Å; A351-P393 HydrophobicContact CB-CG 4.02Å
352	V	88.5	Confident	92.7	Very high	111 Å²	111	55.4 Å²	55.4	67%	0.673	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	60.4	7.6	178	-164.5	0	0	0	0	114.2	S350 Y354 P393	S350-V352 PolarHBondContact O-N 3.23Å; V352-Y354 HydrophobicContact CB-CD2 4.11Å; V352-Y354 HydrophobicContact CB-CE2 4.12Å; V352-Y354 HydrophobicContact CG1-CE2 4.27Å; V352-P393 HydrophobicContact CB-CG 4.26Å; V352-P393 HydrophobicContact CG2-CG 3.86Å
353	G	90.6	Very high	92.8	Very high	41 Å²	41	55.9 Å²	55.9	42%	0.423	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	97	0.5	179	0	0	0	0	0	114.9	S339 S350 A351	S339-G353 PolarHBondContact OG-O 3.12Å; S350-G353 PolarHBondContact O-N 3.42Å; S350-G353 VanDerWaalsContact O-N 3.07Å; A351-G353 PolarHBondContact O-N 2.88Å
354	Y	94	Very high	92.8	Very high	24 Å²	24	54.4 Å²	54.4	9%	0.094	36%	0.358	C	S	.	.			trans	-70.2	162.4	177.5	-69.7	-73.4	0	0	0	112.7	T335 S350 A351 V352 L358 D392 P393 A394	T335-Y354 HydrophobicContact CG2-CD1 4.04Å; T335-Y354 HydrophobicContact CG2-CE1 3.93Å; S350-Y354 WeakPolarHBondContact CB-O 3.09Å; S350-Y354 PolarHBondContact N-O 3.46Å; A351-Y354 WeakPolarHBondContact O-CD2 3.42Å; A351-Y354 PolarHBondContact O-N 2.82Å; V352-Y354 HydrophobicContact CB-CD2 4.11Å; V352-Y354 HydrophobicContact CB-CE2 4.12Å; V352-Y354 HydrophobicContact CG1-CE2 4.27Å; Y354-L358 HydrophobicContact CG-CD2 4.3Å; Y354-D392 WeakPolarHBondContact CE2-OD1 3.35Å; Y354-D392 VanDerWaalsContact CZ-OD1 3.25Å; Y354-D392 PolarHBondContact OH-OD1 2.96Å; Y354-D392 PolarHBondContact OH-OD2 2.92Å; Y354-P393 HydrophobicContact CD2-CB 3.86Å; Y354-P393 HydrophobicContact CD2-CG 4.01Å; Y354-P393 HydrophobicContact CE2-CB 4.2Å; Y354-P393 HydrophobicContact CE2-CG 4.29Å; Y354-A394 HydrophobicContact CE1-CB 3.72Å; Y354-A394 HydrophobicContact CE2-CB 4.16Å; Y354-A394 VanDerWaalsContact CZ-CB 3.49Å; Y354-A394 WeakPolarHBondContact OH-CB 3.38Å
355	Q	94.3	Very high	93	Very high	3 Å²	3	51.4 Å²	51.4	1%	0.014	34%	0.343	C	S	.	.			trans	-64.9	145.2	174.8	72.1	-78.7	19.4	0	0	112.3	S342 T357 L358 D361	S342-Q355 WeakPolarHBondContact OG-CB 3.5Å; Q355-T357 WeakPolarHBondContact CG-OG1 3.33Å; Q355-T357 PolarHBondContact O-N 3.1Å; Q355-T357 VanDerWaalsContact O-N 3.14Å; Q355-L358 HydrophobicContact CG-CB 4.37Å; Q355-L358 WeakPolarHBondContact O-CB 3.46Å; Q355-L358 PolarHBondContact O-N 2.68Å; Q355-D361 WeakPolarHBondContact CG-OD2 3.34Å; Q355-D361 PolarHBondContact NE2-OD2 3.19Å
356	P	94.8	Very high	93.2	Very high	77 Å²	77	51.1 Å²	51.1	50%	0.5	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.2	176.2	27.2	-34.6	0	0	0	112.6	R347 I348	R347-P356 HydrophobicContact CB-CG 4.4Å; I348-P356 WeakPolarHBondContact O-CD 3.42Å
357	T	93.6	Very high	93.4	Very high	35 Å²	35	52.3 Å²	52.3	22%	0.215	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	8.6	178.9	52.8	0	0	0	0	113.8	R347 Q355 A359 T360 D361	R347-T357 PolarHBondContact NH1-OG1 3.07Å; R347-T357 VanDerWaalsContact NH1-OG1 3.11Å; Q355-T357 WeakPolarHBondContact CG-OG1 3.33Å; Q355-T357 PolarHBondContact O-N 3.1Å; Q355-T357 VanDerWaalsContact O-N 3.14Å; T357-A359 VanDerWaalsContact C-N 3.33Å; T357-A359 PolarHBondContact O-N 2.98Å; T357-T360 CarbonylContact O-C 3.57Å; T357-T360 WeakPolarHBondContact O-CA 3.27Å; T357-T360 WeakPolarHBondContact O-CB 3.49Å; T357-T360 PolarHBondContact O-N 3.32Å; T357-D361 WeakPolarHBondContact CB-OD2 3.35Å; T357-D361 VanDerWaalsContact O-CG 3.27Å; T357-D361 PolarHBondContact O-N 3.14Å; T357-D361 PolarHBondContact OG1-OD2 2.95Å
358	L	94	Very high	93.6	Very high	13 Å²	13	48.3 Å²	48.3	7%	0.068	32%	0.315	C	S	.	.	H	α-helix	trans	-48.7	-51	-172.2	173.5	60.9	0	0	0	113.2	T335 Y354 Q355 T360 L362 P393	T335-L358 HydrophobicContact CG2-CD1 3.35Å; Y354-L358 HydrophobicContact CG-CD2 4.3Å; Q355-L358 HydrophobicContact CG-CB 4.37Å; Q355-L358 WeakPolarHBondContact O-CB 3.46Å; Q355-L358 PolarHBondContact O-N 2.68Å; L358-T360 VanDerWaalsContact C-N 3.33Å; L358-T360 PolarHBondContact O-N 3.04Å; L358-L362 WeakPolarHBondContact O-CB 3.49Å; L358-L362 PolarHBondContact O-N 3.31Å; L358-P393 HydrophobicContact CD2-CB 3.91Å
359	A	94.2	Very high	93.7	Very high	63 Å²	63	41.5 Å²	41.5	52%	0.521	28%	0.28	S	S	.	.	H	α-helix	trans	-65.1	-36.7	179.8	0	0	0	0	0	112.6	T357 G363 T397	T357-A359 VanDerWaalsContact C-N 3.33Å; T357-A359 PolarHBondContact O-N 2.98Å; A359-G363 WeakPolarHBondContact O-CA 3.05Å; A359-G363 PolarHBondContact O-N 3.12Å; A359-T397 HydrophobicContact CB-CG2 4.32Å
360	T	94.3	Very high	93.7	Very high	104 Å²	104	38.7 Å²	38.7	64%	0.638	26%	0.261	S	S	*	.	H	α-helix	trans	-72.2	-45	178.8	-51.2	0	0	0	0	111.7	T357 L358 G363 G364	T357-T360 CarbonylContact O-C 3.57Å; T357-T360 WeakPolarHBondContact O-CA 3.27Å; T357-T360 WeakPolarHBondContact O-CB 3.49Å; T357-T360 PolarHBondContact O-N 3.32Å; L358-T360 VanDerWaalsContact C-N 3.33Å; L358-T360 PolarHBondContact O-N 3.04Å; T360-G363 PolarHBondContact O-N 2.96Å; T360-G364 PolarHBondContact O-N 2.69Å
361	D	94.2	Very high	93.8	Very high	43 Å²	43	36.3 Å²	36.3	23%	0.23	24%	0.244	C	C	.	.	H	α-helix	trans	-64.6	-43.3	-178.9	-60.2	-34.2	0	0	0	110.5	Q355 T357	Q355-D361 WeakPolarHBondContact CG-OD2 3.34Å; Q355-D361 PolarHBondContact NE2-OD2 3.19Å; T357-D361 WeakPolarHBondContact CB-OD2 3.35Å; T357-D361 VanDerWaalsContact O-CG 3.27Å; T357-D361 PolarHBondContact O-N 3.14Å; T357-D361 PolarHBondContact OG1-OD2 2.95Å
362	L	94.8	Very high	94.1	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-70.5	-45.2	176.4	-167.9	63.7	0	0	0	111.3	I331 F334 L358 G364 L365 Q366 T397	I331-L362 HydrophobicContact CD1-CD1 3.97Å; I331-L362 HydrophobicContact CG1-CD1 3.99Å; F334-L362 HydrophobicContact CD1-CD1 4.32Å; F334-L362 HydrophobicContact CE1-CD1 4.4Å; L358-L362 WeakPolarHBondContact O-CB 3.49Å; L358-L362 PolarHBondContact O-N 3.31Å; L362-G364 VanDerWaalsContact C-N 3.3Å; L362-G364 PolarHBondContact O-N 3.46Å; L362-L365 PolarHBondContact O-N 3.35Å; L362-L365 VanDerWaalsContact O-N 3.12Å; L362-Q366 HydrophobicContact CD1-CG 4.06Å; L362-Q366 HydrophobicContact CG-CG 3.88Å; L362-Q366 WeakPolarHBondContact O-CB 3.42Å; L362-Q366 VanDerWaalsContact O-CG 3.25Å; L362-Q366 WeakPolarHBondContact O-CG 3.09Å; L362-Q366 PolarHBondContact O-N 3.04Å; L362-T397 HydrophobicContact CD2-CG2 3.88Å
363	G	94.7	Very high	94.2	Very high	13 Å²	13	36.7 Å²	36.7	13%	0.134	23%	0.226	C	C	.	.	H	α-helix	trans	-58.4	-40.5	176.8	0	0	0	0	0	112.7	A359 T360 L365 Q366 E367	A359-G363 WeakPolarHBondContact O-CA 3.05Å; A359-G363 PolarHBondContact O-N 3.12Å; T360-G363 PolarHBondContact O-N 2.96Å; G363-L365 PolarHBondContact O-N 3Å; G363-Q366 PolarHBondContact O-N 3.14Å; G363-E367 VanDerWaalsContact O-CB 3.32Å; G363-E367 WeakPolarHBondContact O-CB 3.36Å; G363-E367 WeakPolarHBondContact O-CG 3.14Å; G363-E367 PolarHBondContact O-N 3.38Å
364	G	94.3	Very high	94.2	Very high	42 Å²	42	41.4 Å²	41.4	43%	0.433	24%	0.235	S	C	.	.	H	α-helix	trans	-60.3	-29.4	177	0	0	0	0	0	113.9	T360 L362 R368	T360-G364 PolarHBondContact O-N 2.69Å; L362-G364 VanDerWaalsContact C-N 3.3Å; L362-G364 PolarHBondContact O-N 3.46Å; G364-R368 WeakPolarHBondContact O-CD 3.37Å
365	L	95.6	Very high	94.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-85.2	-48.3	172.2	-177.6	76.3	0	0	0	111.6	L307 L310 I328 I331 F334 L362 G363	L307-L365 HydrophobicContact CD2-CB 4.25Å; L307-L365 HydrophobicContact CD2-CD1 3.63Å; L307-L365 HydrophobicContact CG-CD1 4.3Å; L310-L365 HydrophobicContact CB-CD1 4.24Å; L310-L365 HydrophobicContact CD2-CD1 3.66Å; L310-L365 HydrophobicContact CD2-CG 4.36Å; L310-L365 WeakPolarHBondContact CD2-O 3.42Å; I328-L365 HydrophobicContact CD1-CD2 4.14Å; I331-L365 HydrophobicContact CD1-CD2 3.51Å; F334-L365 HydrophobicContact CD1-CD2 4.38Å; F334-L365 HydrophobicContact CE1-CD2 4.32Å; F334-L365 HydrophobicContact CE2-CD2 4.48Å; F334-L365 HydrophobicContact CZ-CB 4.38Å; F334-L365 HydrophobicContact CZ-CD2 4.36Å; L362-L365 PolarHBondContact O-N 3.35Å; L362-L365 VanDerWaalsContact O-N 3.12Å; G363-L365 PolarHBondContact O-N 3Å
366	Q	96.1	Very high	94.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-69.8	-38.5	-171.6	-65	-64.6	-12.5	0	0	112.7	K222 L362 G363 R368 I369 H401	K222-Q366 WeakPolarHBondContact CE-O 3.25Å; K222-Q366 PolarHBondContact NZ-O 3.48Å; K222-Q366 VanDerWaalsContact NZ-O 3.14Å; L362-Q366 HydrophobicContact CD1-CG 4.06Å; L362-Q366 HydrophobicContact CG-CG 3.88Å; L362-Q366 WeakPolarHBondContact O-CB 3.42Å; L362-Q366 VanDerWaalsContact O-CG 3.25Å; L362-Q366 WeakPolarHBondContact O-CG 3.09Å; L362-Q366 PolarHBondContact O-N 3.04Å; G363-Q366 PolarHBondContact O-N 3.14Å; Q366-R368 PolarHBondContact O-N 2.94Å; Q366-I369 WeakPolarHBondContact O-CB 3.31Å; Q366-I369 PolarHBondContact O-N 3.49Å; Q366-I369 VanDerWaalsContact O-N 3.1Å; Q366-H401 HydrophobicContact CB-CB 4.07Å; Q366-H401 HydrophobicContact CG-CB 4.03Å
367	E	94.9	Very high	94.1	Very high	88 Å²	88	36.6 Å²	36.6	41%	0.411	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-19.6	-176.6	-65.2	-53.2	132.3	0	0	113.2	A191 K222 G363 I369 H401	A191-E367 HydrophobicContact CB-CB 4.18Å; K222-E367 IonicContact NZ-OE1 3.79Å; G363-E367 VanDerWaalsContact O-CB 3.32Å; G363-E367 WeakPolarHBondContact O-CB 3.36Å; G363-E367 WeakPolarHBondContact O-CG 3.14Å; G363-E367 PolarHBondContact O-N 3.38Å; E367-I369 VanDerWaalsContact C-N 3.31Å; E367-H401 IonicContact OE1-CE1 2.79Å; E367-H401 PolarHBondContact OE1-CE1 3.25Å; E367-H401 IonicContact OE1-ND1 3.63Å; E367-H401 PolarHBondContact OE1-ND1 3.36Å; E367-H401 VanDerWaalsContact OE1-ND1 3.07Å
368	R	96.4	Very high	94.2	Very high	3 Å²	3	35 Å²	35	1%	0.011	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-23.9	171.4	-75	168.9	68.4	177.8	1	112.6	I187 R189 A191 L310 T311 E314 R317 G364 Q366 T370	I187-R368 PolarHBondContact O-NH1 3.31Å; I187-R368 PolarHBondContact O-NH2 2.83Å; R189-R368 WeakPolarHBondContact O-CD 3.3Å; A191-R368 HydrophobicContact CB-CG 4.12Å; L310-R368 HydrophobicContact CD2-CB 3.54Å; L310-R368 HydrophobicContact CD2-CG 4.38Å; L310-R368 HydrophobicContact CG-CB 4.35Å; T311-R368 PolarHBondContact OG1-NH2 3.07Å; E314-R368 VanDerWaalsContact CD-NH2 3.25Å; E314-R368 IonicContact OE1-CZ 3.73Å; E314-R368 IonicContact OE1-NE 3.67Å; E314-R368 PolarHBondContact OE1-NE 3.39Å; E314-R368 IonicContact OE1-NH2 2.76Å; E314-R368 PolarHBondContact OE1-NH2 3.26Å; E314-R368 IonicContact OE2-CZ 3.41Å; E314-R368 IonicContact OE2-NE 2.76Å; E314-R368 IonicContact OE2-NH2 3.27Å; E314-R368 PolarHBondContact OE2-NH2 2.76Å; R317-R368 PolarHBondContact NH1-O 3.28Å; G364-R368 WeakPolarHBondContact O-CD 3.37Å; Q366-R368 PolarHBondContact O-N 2.94Å; R368-T370 PolarHBondContact O-N 3.19Å
369	I	95.6	Very high	94.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	-81.7	97.1	174.8	-58.9	168	0	0	0	107.9	K222 L310 L326 I328 Q366 E367 I377	K222-I369 WeakPolarHBondContact CE-O 3.38Å; K222-I369 HydrophobicContact CG-CB 4.35Å; K222-I369 HydrophobicContact CG-CG2 3.93Å; L310-I369 HydrophobicContact CD1-CG1 3.82Å; L310-I369 HydrophobicContact CD2-CG1 4.24Å; L326-I369 HydrophobicContact CD2-CD1 4Å; L326-I369 HydrophobicContact CD2-CG1 4.15Å; I328-I369 HydrophobicContact CD1-CD1 4.36Å; Q366-I369 WeakPolarHBondContact O-CB 3.31Å; Q366-I369 PolarHBondContact O-N 3.49Å; Q366-I369 VanDerWaalsContact O-N 3.1Å; E367-I369 VanDerWaalsContact C-N 3.31Å; I369-I377 HydrophobicContact CG2-CB 4.49Å; I369-I377 HydrophobicContact CG2-CG2 4.11Å; I369-I377 VanDerWaalsContact CG2-O 3.27Å; I369-I377 WeakPolarHBondContact CG2-O 3.45Å
370	T	94.4	Very high	94.3	Very high	24 Å²	24	31.7 Å²	31.7	15%	0.147	17%	0.171	C	C	.	.	S	Bend	trans	-158.5	167.5	-178	-171.1	0	0	0	0	111.2	P192 Q197 R317 R368 I377	P192-T370 HydrophobicContact CB-CG2 4.23Å; P192-T370 HydrophobicContact CG-CG2 3.74Å; Q197-T370 HydrophobicContact CG-CG2 4.28Å; R317-T370 PolarHBondContact NH1-O 3.39Å; R368-T370 PolarHBondContact O-N 3.19Å; T370-I377 PolarHBondContact O-N 3.09Å
371	T	93.9	Very high	94.3	Very high	21 Å²	21	26.7 Å²	26.7	13%	0.129	14%	0.141	C	C	.	.	B	Isolated β-bridge	trans	-85.7	127.2	170.2	-60.7	0	0	0	0	110.3	Q197 A198 R219 G220 S376	Q197-T371 WeakPolarHBondContact CA-O 3.46Å; A198-T371 HydrophobicContact CB-CG2 3.54Å; A198-T371 PolarHBondContact N-O 2.8Å; R219-T371 PolarHBondContact O-OG1 2.99Å; G220-T371 VanDerWaalsContact CA-OG1 3.25Å; G220-T371 WeakPolarHBondContact CA-OG1 3.43Å; T371-S376 WeakPolarHBondContact OG1-CB 3.34Å
372	T	93.5	Very high	94.2	Very high	10 Å²	10	24.8 Å²	24.8	6%	0.061	13%	0.131	C	C	.	.	B	Isolated β-bridge	trans	-105	172.1	169.1	70.4	0	0	0	0	110.3	P192 E196 K374 G375	P192-T372 HydrophobicContact CB-CG2 3.84Å; P192-T372 HydrophobicContact CG-CG2 3.85Å; E196-T372 CarbonylContact O-C 3.49Å; E196-T372 WeakPolarHBondContact O-CA 3.12Å; T372-K374 PolarHBondContact O-N 3.39Å; T372-K374 VanDerWaalsContact O-N 3.13Å; T372-K374 PolarHBondContact OG1-N 3.33Å; T372-G375 PolarHBondContact N-O 2.81Å; T372-G375 PolarHBondContact O-N 3.23Å; T372-G375 PolarHBondContact OG1-N 3.48Å; T372-G375 PolarHBondContact OG1-O 3.08Å; T372-G375 VanDerWaalsContact OG1-O 3.11Å
373	K	90.5	Very high	93.9	Very high	166 Å²	166	25 Å²	25	72%	0.722	13%	0.132	S	C	*	.	S	Bend	trans	-59.3	-20.7	173.6	-70.3	173.9	-179	172.6	0	114.1	V195 E196	V195-K373 WeakPolarHBondContact O-CE 3.41Å; V195-K373 PolarHBondContact O-NZ 3.2Å; E196-K373 PolarHBondContact O-N 3.27Å
374	K	90.6	Very high	93.4	Very high	140 Å²	140	30.3 Å²	30.3	61%	0.609	15%	0.149	S	C	*	.	S	Bend	trans	-95	-35.3	-176.9	-65.8	-177.9	178.1	176.3	0	112.9	D318 G321 T372	D318-K374 VanDerWaalsContact O-CD 3.26Å; D318-K374 WeakPolarHBondContact O-CD 3.41Å; D318-K374 PolarHBondContact O-NZ 3.36Å; G321-K374 CarbonylContact C-O 2.89Å; G321-K374 VanDerWaalsContact C-O 3.28Å; G321-K374 VanDerWaalsContact CA-O 3.25Å; G321-K374 WeakPolarHBondContact CA-O 3.49Å; G321-K374 VanDerWaalsContact O-O 3.08Å; T372-K374 PolarHBondContact O-N 3.39Å; T372-K374 VanDerWaalsContact O-N 3.13Å; T372-K374 PolarHBondContact OG1-N 3.33Å
375	G	92.1	Very high	92.8	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.01	13%	0.134	C	C	.	.			trans	-175.6	-178.9	-176.2	0	0	0	0	0	111.3	R317 T372	R317-G375 WeakPolarHBondContact CG-O 3.13Å; T372-G375 PolarHBondContact N-O 2.81Å; T372-G375 PolarHBondContact O-N 3.23Å; T372-G375 PolarHBondContact OG1-N 3.48Å; T372-G375 PolarHBondContact OG1-O 3.08Å; T372-G375 VanDerWaalsContact OG1-O 3.11Å
376	S	93.9	Very high	92	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.007	14%	0.142	C	C	.	.	B	Isolated β-bridge	trans	-127.4	153.3	-179.2	68.8	0	0	0	0	113.1	R219 D323 V324 T371	R219-S376 WeakPolarHBondContact CG-OG 3.23Å; D323-S376 WeakPolarHBondContact CA-O 3.37Å; D323-S376 WeakPolarHBondContact OD1-CB 3.37Å; D323-S376 PolarHBondContact OD1-N 2.86Å; D323-S376 PolarHBondContact OD1-OG 3.02Å; V324-S376 PolarHBondContact N-O 3.05Å; T371-S376 WeakPolarHBondContact OG1-CB 3.34Å
377	I	95.6	Very high	91.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	106.6	164.3	-63.2	165.3	0	0	0	107	G220 L310 A313 E314 R317 V324 L326 I369 T370	G220-I377 CarbonylContact C-O 3.57Å; G220-I377 VanDerWaalsContact CA-O 3.28Å; G220-I377 WeakPolarHBondContact CA-O 3.34Å; L310-I377 HydrophobicContact CD1-CD1 3.96Å; L310-I377 HydrophobicContact CD1-CG2 4.44Å; A313-I377 HydrophobicContact CB-CD1 4.16Å; A313-I377 HydrophobicContact CB-CG1 4.37Å; A313-I377 HydrophobicContact CB-CG2 4.45Å; E314-I377 HydrophobicContact CB-CD1 4.38Å; E314-I377 HydrophobicContact CG-CD1 3.73Å; R317-I377 HydrophobicContact CB-CD1 4.22Å; R317-I377 HydrophobicContact CB-CG1 4.01Å; R317-I377 HydrophobicContact CG-CG1 4.34Å; V324-I377 HydrophobicContact CB-CG1 4.38Å; V324-I377 WeakPolarHBondContact O-CA 3.3Å; L326-I377 HydrophobicContact CB-CG2 3.73Å; L326-I377 HydrophobicContact CD2-CG2 4.21Å; I369-I377 HydrophobicContact CG2-CB 4.49Å; I369-I377 HydrophobicContact CG2-CG2 4.11Å; I369-I377 VanDerWaalsContact CG2-O 3.27Å; I369-I377 WeakPolarHBondContact CG2-O 3.45Å; T370-I377 PolarHBondContact O-N 3.09Å
378	T	95.2	Very high	90.3	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.018	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	126.1	172.6	-51.4	0	0	0	0	108	L204 Q218 G220 I223 V324 L325 L326	L204-T378 HydrophobicContact CD2-CG2 3.93Å; Q218-T378 WeakPolarHBondContact O-CG2 3.17Å; G220-T378 PolarHBondContact N-OG1 3.26Å; I223-T378 HydrophobicContact CD1-CG2 3.45Å; I223-T378 VanDerWaalsContact CD1-CG2 3.45Å; V324-T378 PolarHBondContact O-N 3.33Å; L325-T378 CarbonylContact C-O 3.56Å; L325-T378 WeakPolarHBondContact CA-O 3.37Å; L325-T378 HydrophobicContact CD2-CG2 4.29Å; L326-T378 PolarHBondContact N-O 3.15Å
379	S	95.7	Very high	89.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	138.3	-176	66.8	0	0	0	0	113.1	G221 K222 I223 L326 Q381	G221-S379 PolarHBondContact O-N 3.39Å; K222-S379 WeakPolarHBondContact CA-OG 3.33Å; I223-S379 WeakPolarHBondContact CB-O 3.45Å; I223-S379 WeakPolarHBondContact CD1-O 3.44Å; I223-S379 PolarHBondContact N-O 3.43Å; L326-S379 CarbonylContact O-C 3.6Å; L326-S379 WeakPolarHBondContact O-CA 3.45Å; S379-Q381 PolarHBondContact OG-NE2 2.81Å
380	V	94.8	Very high	88.8	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.03	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	111.1	169.9	-178.5	0	0	0	0	107.6	Y217 I223 L225 L240 L326 F327 I328	Y217-V380 HydrophobicContact CE2-CG2 4.42Å; I223-V380 HydrophobicContact CB-CG2 4.36Å; L225-V380 HydrophobicContact CB-CG1 4.18Å; L225-V380 HydrophobicContact CD2-CG1 4.44Å; L240-V380 HydrophobicContact CD1-CG2 4.27Å; L326-V380 PolarHBondContact O-N 2.74Å; F327-V380 WeakPolarHBondContact CA-O 3.46Å; F327-V380 HydrophobicContact CD1-CB 3.7Å; F327-V380 HydrophobicContact CD1-CG1 4.2Å; F327-V380 HydrophobicContact CD1-CG2 4.38Å; F327-V380 HydrophobicContact CE1-CB 3.72Å; F327-V380 HydrophobicContact CE1-CG1 4.2Å; F327-V380 HydrophobicContact CE1-CG2 3.93Å; I328-V380 PolarHBondContact N-O 3.27Å
381	Q	94.7	Very high	88.5	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	117	-168.3	-51.7	-177.3	25.2	0	0	108.9	I223 G224 L225 I328 I331 S379 I383	I223-Q381 PolarHBondContact O-N 3.29Å; G224-Q381 CarbonylContact C-O 3.56Å; L225-Q381 PolarHBondContact N-O 2.7Å; I328-Q381 HydrophobicContact CB-CB 4.36Å; I328-Q381 HydrophobicContact CB-CG 4.15Å; I328-Q381 HydrophobicContact CD1-CG 4.2Å; I328-Q381 HydrophobicContact CG1-CG 4.3Å; I328-Q381 CarbonylContact O-C 3.54Å; I328-Q381 WeakPolarHBondContact O-CA 3.3Å; I331-Q381 HydrophobicContact CB-CB 4.27Å; I331-Q381 HydrophobicContact CG2-CB 4.2Å; S379-Q381 PolarHBondContact OG-NE2 2.81Å; Q381-I383 PolarHBondContact O-N 3.2Å
382	A	91.4	Very high	88.3	Confident	2 Å²	2	49.8 Å²	49.8	2%	0.017	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	131.7	173.1	0	0	0	0	0	109	L225 I328 D329 N330 I331	L225-A382 WeakPolarHBondContact O-CA 3.32Å; I328-A382 PolarHBondContact O-N 3.02Å; D329-A382 HydrophobicContact CB-CB 4.35Å; D329-A382 WeakPolarHBondContact OD1-CB 3.38Å; N330-A382 HydrophobicContact CB-CB 4.41Å; N330-A382 PolarHBondContact ND2-O 3.43Å; N330-A382 PolarHBondContact OD1-O 2.76Å; I331-A382 WeakPolarHBondContact CG2-O 3.32Å; I331-A382 PolarHBondContact N-O 3.35Å
383	I	88	Confident	88.2	Confident	7 Å²	7	50.6 Å²	50.6	4%	0.036	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	128	-179.5	-62.5	163.9	0	0	0	108.8	L225 F226 I331 Q381 V385 T398 L402	L225-I383 PolarHBondContact O-N 2.76Å; F226-I383 HydrophobicContact CD1-CB 4.08Å; F226-I383 HydrophobicContact CD1-CG2 4.19Å; F226-I383 HydrophobicContact CE1-CB 3.55Å; F226-I383 HydrophobicContact CE1-CD1 4.11Å; F226-I383 HydrophobicContact CE1-CG1 4.44Å; F226-I383 HydrophobicContact CE1-CG2 3.39Å; F226-I383 HydrophobicContact CE2-CB 4.41Å; F226-I383 HydrophobicContact CE2-CD1 3.79Å; F226-I383 HydrophobicContact CZ-CB 3.71Å; F226-I383 HydrophobicContact CZ-CD1 3.35Å; F226-I383 HydrophobicContact CZ-CG1 4.11Å; F226-I383 HydrophobicContact CZ-CG2 3.8Å; I331-I383 HydrophobicContact CG2-CB 4.47Å; I331-I383 HydrophobicContact CG2-CD1 4.48Å; I331-I383 HydrophobicContact CG2-CG1 3.51Å; Q381-I383 PolarHBondContact O-N 3.2Å; I383-V385 HydrophobicContact CG2-CG2 4.45Å; I383-T398 HydrophobicContact CD1-CG2 3.88Å; I383-T398 HydrophobicContact CG1-CG2 4.26Å; I383-L402 HydrophobicContact CD1-CD1 3.41Å; I383-L402 VanDerWaalsContact CD1-CD1 3.41Å; I383-L402 HydrophobicContact CD1-CD2 4.3Å; I383-L402 HydrophobicContact CD1-CG 4.41Å
384	Y	84.9	Confident	88.1	Confident	124 Å²	124	42.7 Å²	42.7	49%	0.486	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-100.5	124	169.4	175.8	-96.7	0	0	0	109	N330 F332 P386	N330-Y384 PolarHBondContact ND2-N 3.05Å; N330-Y384 PolarHBondContact OD1-N 2.94Å; F332-Y384 AromaticContact CD1-CD1 3.64Å; F332-Y384 HydrophobicContact CD1-CD1 3.64Å; F332-Y384 HydrophobicContact CD1-CG 4.3Å; F332-Y384 WeakPolarHBondContact CD2-O 3.2Å; F332-Y384 AromaticContact CE1-CD1 3.66Å; F332-Y384 HydrophobicContact CE1-CD1 3.66Å; F332-Y384 HydrophobicContact CE1-CE1 4.19Å; F332-Y384 HydrophobicContact CG-CD1 4.15Å; F332-Y384 HydrophobicContact CZ-CD1 4.19Å; Y384-P386 HydrophobicContact CE1-CB 4.22Å
385	V	81	Confident	88.1	Confident	19 Å²	19	36.1 Å²	36.1	12%	0.115	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-96.3	116	174.8	-176.2	0	0	0	0	107.9	F226 I383 A387 D389 L390	F226-V385 HydrophobicContact CD1-CG2 3.98Å; F226-V385 HydrophobicContact CE1-CG2 3.81Å; I383-V385 HydrophobicContact CG2-CG2 4.45Å; V385-A387 PolarHBondContact O-N 2.85Å; V385-D389 WeakPolarHBondContact CG1-O 3.36Å; V385-L390 HydrophobicContact CG1-CD2 4.04Å; V385-L390 HydrophobicContact CG2-CD2 4.02Å
386	P	79	Confident	88	Confident	25 Å²	25	38.1 Å²	38.1	16%	0.162	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-67.2	129.6	178.8	28.1	-32.8	0	0	0	110.1	F332 Y384 D388 D389 D392	F332-P386 HydrophobicContact CE2-CG 4.12Å; F332-P386 HydrophobicContact CZ-CB 4.43Å; F332-P386 HydrophobicContact CZ-CG 4.33Å; Y384-P386 HydrophobicContact CE1-CB 4.22Å; P386-D388 PolarHBondContact O-N 3.43Å; P386-D389 PolarHBondContact O-N 3.4Å; P386-D392 HydrophobicContact CG-CB 3.96Å
387	A	78.5	Confident	87.9	Confident	94 Å²	94	39.6 Å²	39.6	78%	0.777	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	52.7	25.4	177.3	0	0	0	0	0	115	V385 D389	V385-A387 PolarHBondContact O-N 2.85Å; A387-D389 PolarHBondContact O-N 2.99Å; A387-D389 VanDerWaalsContact O-N 3.12Å
388	D	77.1	Confident	87.8	Confident	148 Å²	148	39.8 Å²	39.8	79%	0.791	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	55.9	20.8	-173.3	-56.9	-45.6	0	0	0	114	P386 L390	P386-D388 PolarHBondContact O-N 3.43Å; D388-L390 PolarHBondContact O-N 3.4Å
389	D	81.3	Confident	87.5	Confident	69 Å²	69	42.4 Å²	42.4	37%	0.369	24%	0.244	S	C	.	.			trans	-89	100	177.1	-174.2	4.6	0	0	0	111.3	V385 P386 A387 T391 D392	V385-D389 WeakPolarHBondContact CG1-O 3.36Å; P386-D389 PolarHBondContact O-N 3.4Å; A387-D389 PolarHBondContact O-N 2.99Å; A387-D389 VanDerWaalsContact O-N 3.12Å; D389-T391 PolarHBondContact O-N 3.09Å; D389-T391 WeakPolarHBondContact OD1-CA 3.4Å; D389-T391 WeakPolarHBondContact OD1-CB 3.33Å; D389-T391 PolarHBondContact OD1-N 2.84Å; D389-T391 PolarHBondContact OD1-OG1 3.02Å; D389-T391 PolarHBondContact OD2-OG1 3.45Å; D389-D392 WeakPolarHBondContact O-CB 3.45Å; D389-D392 PolarHBondContact O-N 3.18Å
390	L	79.9	Confident	87.3	Confident	103 Å²	103	45.7 Å²	45.7	54%	0.539	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-14	175.5	-62.6	173.6	0	0	0	113.2	V385 D388 D392 F399	V385-L390 HydrophobicContact CG1-CD2 4.04Å; V385-L390 HydrophobicContact CG2-CD2 4.02Å; D388-L390 PolarHBondContact O-N 3.4Å; L390-D392 VanDerWaalsContact C-N 3.33Å; L390-F399 HydrophobicContact CD2-CE2 3.66Å; L390-F399 HydrophobicContact CD2-CZ 3.74Å
391	T	87	Confident	87.3	Confident	114 Å²	114	47.1 Å²	47.1	70%	0.699	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-7.2	178.5	74.9	0	0	0	0	113	D389	D389-T391 PolarHBondContact O-N 3.09Å; D389-T391 WeakPolarHBondContact OD1-CA 3.4Å; D389-T391 WeakPolarHBondContact OD1-CB 3.33Å; D389-T391 PolarHBondContact OD1-N 2.84Å; D389-T391 PolarHBondContact OD1-OG1 3.02Å; D389-T391 PolarHBondContact OD2-OG1 3.45Å
392	D	90	Very high	87.2	Confident	14 Å²	14	47.4 Å²	47.4	8%	0.075	28%	0.279	C	S	.	.	S	Bend	trans	-56.7	136	172.5	-177.1	-78.3	0	0	0	110.2	Y354 P386 D389 L390 A394 P395 A396	Y354-D392 WeakPolarHBondContact CE2-OD1 3.35Å; Y354-D392 VanDerWaalsContact CZ-OD1 3.25Å; Y354-D392 PolarHBondContact OH-OD1 2.96Å; Y354-D392 PolarHBondContact OH-OD2 2.92Å; P386-D392 HydrophobicContact CG-CB 3.96Å; D389-D392 WeakPolarHBondContact O-CB 3.45Å; D389-D392 PolarHBondContact O-N 3.18Å; L390-D392 VanDerWaalsContact C-N 3.33Å; D392-A394 PolarHBondContact O-N 3.24Å; D392-A394 VanDerWaalsContact O-N 3.14Å; D392-A394 WeakPolarHBondContact OD1-CB 3.49Å; D392-A394 PolarHBondContact OD1-N 2.81Å; D392-P395 HydrophobicContact CB-CG 3.8Å; D392-P395 WeakPolarHBondContact O-CD 3.47Å; D392-P395 WeakPolarHBondContact O-CG 3.34Å; D392-P395 WeakPolarHBondContact OD1-CD 3.38Å; D392-A396 WeakPolarHBondContact O-CB 3.41Å; D392-A396 PolarHBondContact O-N 3.32Å
393	P	91.2	Very high	87.3	Confident	27 Å²	27	48.5 Å²	48.5	18%	0.175	28%	0.284	C	S	.	.	H	α-helix	trans	-55.3	-32.7	-176.5	-28.9	34.5	0	0	0	115	A351 V352 Y354 L358 T397	A351-P393 HydrophobicContact CB-CG 4.02Å; V352-P393 HydrophobicContact CB-CG 4.26Å; V352-P393 HydrophobicContact CG2-CG 3.86Å; Y354-P393 HydrophobicContact CD2-CB 3.86Å; Y354-P393 HydrophobicContact CD2-CG 4.01Å; Y354-P393 HydrophobicContact CE2-CB 4.2Å; Y354-P393 HydrophobicContact CE2-CG 4.29Å; L358-P393 HydrophobicContact CD2-CB 3.91Å; P393-T397 VanDerWaalsContact O-CB 3.32Å; P393-T397 WeakPolarHBondContact O-CB 3.37Å; P393-T397 PolarHBondContact O-N 3.44Å; P393-T397 PolarHBondContact O-OG1 3.47Å
394	A	89.1	Confident	87.6	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-68.1	-57.6	-178	0	0	0	0	0	113.4	F332 T335 Y354 D392 A396 T398	F332-A394 HydrophobicContact CD2-CB 4.06Å; F332-A394 HydrophobicContact CE2-CB 3.89Å; T335-A394 HydrophobicContact CG2-CB 3.68Å; Y354-A394 HydrophobicContact CE1-CB 3.72Å; Y354-A394 HydrophobicContact CE2-CB 4.16Å; Y354-A394 VanDerWaalsContact CZ-CB 3.49Å; Y354-A394 WeakPolarHBondContact OH-CB 3.38Å; D392-A394 PolarHBondContact O-N 3.24Å; D392-A394 VanDerWaalsContact O-N 3.14Å; D392-A394 WeakPolarHBondContact OD1-CB 3.49Å; D392-A394 PolarHBondContact OD1-N 2.81Å; A394-A396 VanDerWaalsContact C-N 3.35Å; A394-T398 PolarHBondContact O-N 3.07Å; A394-T398 VanDerWaalsContact O-N 3.1Å; A394-T398 PolarHBondContact O-OG1 3.21Å
395	P	89.4	Confident	88	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-63.2	-40.7	173.8	25.6	-33.5	0	0	0	111.2	D392 T397 T398 F399	D392-P395 HydrophobicContact CB-CG 3.8Å; D392-P395 WeakPolarHBondContact O-CD 3.47Å; D392-P395 WeakPolarHBondContact O-CG 3.34Å; D392-P395 WeakPolarHBondContact OD1-CD 3.38Å; P395-T397 VanDerWaalsContact C-N 3.33Å; P395-T397 PolarHBondContact O-N 2.82Å; P395-T398 WeakPolarHBondContact O-CB 3.36Å; P395-T398 PolarHBondContact O-N 3.23Å; P395-F399 VanDerWaalsContact C-CD2 3.46Å; P395-F399 HydrophobicContact CB-CD2 4.19Å; P395-F399 HydrophobicContact CB-CE2 3.8Å; P395-F399 WeakPolarHBondContact O-CD2 3.32Å; P395-F399 WeakPolarHBondContact O-CG 3.39Å; P395-F399 PolarHBondContact O-N 3.37Å
396	A	90.8	Very high	88.6	Confident	43 Å²	43	42.5 Å²	42.5	36%	0.355	26%	0.261	S	S	.	.	H	α-helix	trans	-56.8	-44.2	179.3	0	0	0	0	0	112.8	D392 A394 A400	D392-A396 WeakPolarHBondContact O-CB 3.41Å; D392-A396 PolarHBondContact O-N 3.32Å; A394-A396 VanDerWaalsContact C-N 3.35Å; A396-A400 PolarHBondContact O-N 3.4Å
397	T	92	Very high	89.3	Confident	33 Å²	33	42.7 Å²	42.7	20%	0.202	26%	0.262	C	S	.	.	H	α-helix	trans	-68.9	-39	176.4	-51.2	0	0	0	0	111.2	A359 L362 P393 P395 A400 H401	A359-T397 HydrophobicContact CB-CG2 4.32Å; L362-T397 HydrophobicContact CD2-CG2 3.88Å; P393-T397 VanDerWaalsContact O-CB 3.32Å; P393-T397 WeakPolarHBondContact O-CB 3.37Å; P393-T397 PolarHBondContact O-N 3.44Å; P393-T397 PolarHBondContact O-OG1 3.47Å; P395-T397 VanDerWaalsContact C-N 3.33Å; P395-T397 PolarHBondContact O-N 2.82Å; T397-A400 WeakPolarHBondContact O-CB 3.43Å; T397-A400 PolarHBondContact O-N 2.82Å; T397-H401 PolarHBondContact O-CD2 3.14Å; T397-H401 VanDerWaalsContact O-CD2 3.3Å
398	T	92	Very high	89.9	Confident	3 Å²	3	38.6 Å²	38.6	2%	0.018	23%	0.227	C	C	.	.	H	α-helix	trans	-62.7	-44.9	177.2	-52.9	0	0	0	0	111.3	I331 I383 A394 P395 A400 H401 L402	I331-T398 HydrophobicContact CG2-CG2 4.03Å; I383-T398 HydrophobicContact CD1-CG2 3.88Å; I383-T398 HydrophobicContact CG1-CG2 4.26Å; A394-T398 PolarHBondContact O-N 3.07Å; A394-T398 VanDerWaalsContact O-N 3.1Å; A394-T398 PolarHBondContact O-OG1 3.21Å; P395-T398 WeakPolarHBondContact O-CB 3.36Å; P395-T398 PolarHBondContact O-N 3.23Å; T398-A400 PolarHBondContact O-N 3.34Å; T398-H401 PolarHBondContact O-N 3.38Å; T398-L402 HydrophobicContact CG2-CD2 4.4Å; T398-L402 HydrophobicContact CG2-CG 4.49Å; T398-L402 WeakPolarHBondContact O-CG 3.46Å; T398-L402 PolarHBondContact O-N 2.97Å
399	F	90.8	Very high	90.6	Very high	59 Å²	59	32.4 Å²	32.4	26%	0.259	20%	0.195	S	C	.	.	H	α-helix	trans	-57.6	-31.7	179	-76.7	-56.8	0	0	0	113.6	F226 L390 P395 H401 L402	F226-F399 AromaticContact CE1-CE1 3.8Å; F226-F399 HydrophobicContact CE1-CE1 3.8Å; F226-F399 AromaticContact CE1-CZ 3.54Å; F226-F399 HydrophobicContact CE1-CZ 3.54Å; F226-F399 AromaticContact CE2-CE1 3.86Å; F226-F399 HydrophobicContact CE2-CE1 3.86Å; F226-F399 HydrophobicContact CE2-CZ 4.43Å; F226-F399 HydrophobicContact CZ-CD1 4.16Å; F226-F399 AromaticContact CZ-CE1 3.12Å; F226-F399 HydrophobicContact CZ-CE1 3.12Å; F226-F399 AromaticContact CZ-CZ 3.39Å; F226-F399 HydrophobicContact CZ-CZ 3.39Å; L390-F399 HydrophobicContact CD2-CE2 3.66Å; L390-F399 HydrophobicContact CD2-CZ 3.74Å; P395-F399 VanDerWaalsContact C-CD2 3.46Å; P395-F399 HydrophobicContact CB-CD2 4.19Å; P395-F399 HydrophobicContact CB-CE2 3.8Å; P395-F399 WeakPolarHBondContact O-CD2 3.32Å; P395-F399 WeakPolarHBondContact O-CG 3.39Å; P395-F399 PolarHBondContact O-N 3.37Å; F399-H401 PolarHBondContact O-N 3.17Å; F399-L402 HydrophobicContact CD1-CD1 3.79Å; F399-L402 HydrophobicContact CE1-CD1 4.29Å; F399-L402 PolarHBondContact O-N 3.07Å
400	A	91.5	Very high	91	Very high	69 Å²	69	36.2 Å²	36.2	57%	0.57	20%	0.204	S	C	*	.	H	α-helix	trans	-60.5	-31.9	177.2	0	0	0	0	0	112.3	A396 T397 T398 R429	A396-A400 PolarHBondContact O-N 3.4Å; T397-A400 WeakPolarHBondContact O-CB 3.43Å; T397-A400 PolarHBondContact O-N 2.82Å; T398-A400 PolarHBondContact O-N 3.34Å; A400-R429 PolarHBondContact O-NH2 2.71Å
401	H	93.6	Very high	91.5	Very high	34 Å²	34	37.7 Å²	37.7	16%	0.157	21%	0.209	C	C	.	.	H	α-helix	trans	-89.9	-15.8	-179	-62	-78.3	0	0	0	114	K222 Q366 E367 T397 T398 F399	K222-H401 HydrophobicContact CD-CB 4.3Å; K222-H401 WeakPolarHBondContact CD-O 3.3Å; Q366-H401 HydrophobicContact CB-CB 4.07Å; Q366-H401 HydrophobicContact CG-CB 4.03Å; E367-H401 IonicContact OE1-CE1 2.79Å; E367-H401 PolarHBondContact OE1-CE1 3.25Å; E367-H401 IonicContact OE1-ND1 3.63Å; E367-H401 PolarHBondContact OE1-ND1 3.36Å; E367-H401 VanDerWaalsContact OE1-ND1 3.07Å; T397-H401 PolarHBondContact O-CD2 3.14Å; T397-H401 VanDerWaalsContact O-CD2 3.3Å; T398-H401 PolarHBondContact O-N 3.38Å; F399-H401 PolarHBondContact O-N 3.17Å
402	L	93.3	Very high	91.8	Very high	7 Å²	7	33.2 Å²	33.2	4%	0.037	18%	0.18	C	C	.	.			trans	-78.5	138.2	-174.9	-57.5	176	0	0	0	112.7	K222 F226 I383 T398 F399 R429	K222-L402 HydrophobicContact CB-CD2 4.11Å; K222-L402 CarbonylContact O-C 3.59Å; K222-L402 WeakPolarHBondContact O-CA 3.18Å; F226-L402 HydrophobicContact CE2-CD1 4.49Å; F226-L402 HydrophobicContact CZ-CD1 4.45Å; I383-L402 HydrophobicContact CD1-CD1 3.41Å; I383-L402 VanDerWaalsContact CD1-CD1 3.41Å; I383-L402 HydrophobicContact CD1-CD2 4.3Å; I383-L402 HydrophobicContact CD1-CG 4.41Å; T398-L402 HydrophobicContact CG2-CD2 4.4Å; T398-L402 HydrophobicContact CG2-CG 4.49Å; T398-L402 WeakPolarHBondContact O-CG 3.46Å; T398-L402 PolarHBondContact O-N 2.97Å; F399-L402 HydrophobicContact CD1-CD1 3.79Å; F399-L402 HydrophobicContact CE1-CD1 4.29Å; F399-L402 PolarHBondContact O-N 3.07Å; L402-R429 PolarHBondContact O-NE 3.4Å; L402-R429 PolarHBondContact O-NH1 3.22Å; L402-R429 PolarHBondContact O-NH2 2.97Å
403	D	93.4	Very high	91.8	Very high	24 Å²	24	33.4 Å²	33.4	13%	0.128	18%	0.183	C	C	.	.	S	Bend	trans	-95.7	-27.5	175	-57.7	-58.9	0	0	0	112.5	Q218 G221 K222 R429	Q218-D403 HydrophobicContact CB-CB 4.48Å; G221-D403 WeakPolarHBondContact CA-OD2 3.26Å; K222-D403 PolarHBondContact N-OD2 2.86Å; K222-D403 PolarHBondContact O-N 2.99Å; D403-R429 WeakPolarHBondContact O-CB 3.48Å; D403-R429 WeakPolarHBondContact O-CG 3.46Å; D403-R429 PolarHBondContact O-N 2.79Å; D403-R429 IonicContact OD1-CZ 2.75Å; D403-R429 IonicContact OD1-NH1 3.21Å; D403-R429 PolarHBondContact OD1-NH1 2.97Å
404	A	93.3	Very high	91.7	Very high	3 Å²	3	39.1 Å²	39.1	3%	0.025	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	153.3	174.8	0	0	0	0	0	111.3	Y217 K222 I223 G224 T427	Y217-A404 HydrophobicContact CD1-CB 4.29Å; K222-A404 PolarHBondContact O-N 2.94Å; I223-A404 CarbonylContact C-O 3.6Å; I223-A404 WeakPolarHBondContact CA-O 3.37Å; I223-A404 HydrophobicContact CG1-CB 4.22Å; I223-A404 HydrophobicContact CG2-CB 4.48Å; G224-A404 PolarHBondContact N-O 3.15Å; A404-T427 CarbonylContact C-O 3.57Å; A404-T427 WeakPolarHBondContact CA-O 3.46Å
405	T	93.4	Very high	91.8	Very high	21 Å²	21	44.3 Å²	44.3	13%	0.129	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	118.7	178.7	-69	0	0	0	0	107.9	G224 F226 V407 S426 T427	G224-T405 CarbonylContact O-C 3.58Å; G224-T405 WeakPolarHBondContact O-CA 3.45Å; F226-T405 HydrophobicContact CD2-CG2 3.52Å; F226-T405 HydrophobicContact CE2-CG2 3.44Å; F226-T405 VanDerWaalsContact CE2-CG2 3.44Å; F226-T405 HydrophobicContact CZ-CG2 4.48Å; T405-V407 HydrophobicContact CG2-CG2 3.84Å; T405-S426 CarbonylContact O-C 3.53Å; T405-S426 WeakPolarHBondContact O-CA 3.33Å; T405-S426 WeakPolarHBondContact O-CB 3.38Å; T405-T427 PolarHBondContact N-O 3.17Å; T405-T427 PolarHBondContact O-N 2.94Å
406	T	94.4	Very high	91.8	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	115.8	173.3	-57.6	0	0	0	0	108.6	Y217 G224 L225 F226 L236 V421	Y217-T406 WeakPolarHBondContact CE1-OG1 3.35Å; Y217-T406 PolarHBondContact OH-OG1 3.42Å; G224-T406 PolarHBondContact O-N 2.99Å; L225-T406 WeakPolarHBondContact CA-O 3.45Å; L225-T406 HydrophobicContact CD1-CG2 4.02Å; F226-T406 PolarHBondContact N-O 2.88Å; L236-T406 HydrophobicContact CD2-CG2 4.37Å; T406-V421 HydrophobicContact CG2-CG1 3.93Å; T406-V421 HydrophobicContact CG2-CG2 3.9Å
407	V	93.1	Very high	91.9	Very high	30 Å²	30	44 Å²	44	18%	0.182	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	122.6	-179.6	-177.4	0	0	0	0	109.2	F226 T405 V421 D422 D425 S426	F226-V407 HydrophobicContact CB-CB 4.47Å; F226-V407 HydrophobicContact CB-CG1 4.37Å; F226-V407 HydrophobicContact CB-CG2 4.2Å; F226-V407 HydrophobicContact CD2-CG2 4.4Å; T405-V407 HydrophobicContact CG2-CG2 3.84Å; V407-V421 CarbonylContact O-C 3.58Å; V407-V421 WeakPolarHBondContact O-CA 3.22Å; V407-D422 HydrophobicContact CB-CB 4.35Å; V407-D422 HydrophobicContact CG1-CB 4.44Å; V407-D422 PolarHBondContact O-N 3.05Å; V407-D425 HydrophobicContact CB-CB 4.09Å; V407-D425 HydrophobicContact CG1-CB 4.26Å; V407-D425 HydrophobicContact CG2-CB 4Å; V407-D425 WeakPolarHBondContact CG2-O 3.35Å; V407-S426 PolarHBondContact N-OG 3.43Å
408	L	92.5	Very high	91.9	Very high	7 Å²	7	47.3 Å²	47.3	4%	0.037	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	112.7	170.2	-65.4	175.9	0	0	0	109.9	L225 F226 G227 V231 K233 L236 A420 V421	L225-L408 HydrophobicContact CD1-CD1 4.04Å; L225-L408 HydrophobicContact CD1-CG 4.14Å; F226-L408 WeakPolarHBondContact O-CB 3.48Å; F226-L408 PolarHBondContact O-N 3.38Å; G227-L408 WeakPolarHBondContact CA-O 3.24Å; V231-L408 HydrophobicContact CB-CB 4.08Å; V231-L408 HydrophobicContact CG2-CB 3.46Å; V231-L408 VanDerWaalsContact CG2-CB 3.46Å; V231-L408 HydrophobicContact CG2-CD1 3.92Å; V231-L408 HydrophobicContact CG2-CG 4.35Å; K233-L408 HydrophobicContact CB-CD1 4.25Å; K233-L408 HydrophobicContact CG-CD1 3.57Å; L236-L408 HydrophobicContact CD2-CD1 4.3Å; L236-L408 HydrophobicContact CD2-CD2 4.27Å; L408-A420 CarbonylContact C-O 3.44Å; L408-A420 WeakPolarHBondContact CA-O 3.36Å; L408-A420 HydrophobicContact CD2-CB 4.46Å; L408-V421 HydrophobicContact CD2-CB 4.27Å; L408-V421 HydrophobicContact CD2-CG2 3.49Å; L408-V421 VanDerWaalsContact CD2-CG2 3.49Å
409	S	90.8	Very high	91.9	Very high	18 Å²	18	47.7 Å²	47.7	13%	0.126	24%	0.243	C	C	.	.			trans	-96	135.8	-174.8	177.1	0	0	0	0	111.8	Q411 I412 S413 A420	S409-Q411 VanDerWaalsContact C-N 3.28Å; S409-Q411 PolarHBondContact O-N 2.94Å; S409-Q411 PolarHBondContact OG-N 3.17Å; S409-I412 PolarHBondContact O-N 2.97Å; S409-S413 PolarHBondContact O-N 3.21Å; S409-A420 PolarHBondContact N-O 2.84Å
410	R	90.5	Very high	92	Very high	149 Å²	149	44.9 Å²	44.9	56%	0.562	23%	0.232	S	C	*	.	H	α-helix	trans	-61.9	-38.4	172.2	-177.5	179.2	-69.8	166.6	-0.2	111.4	V231 I412 S413 E414	V231-R410 HydrophobicContact CG1-CB 4.39Å; R410-I412 PolarHBondContact O-N 3.28Å; R410-S413 WeakPolarHBondContact CA-OG 3.2Å; R410-S413 PolarHBondContact O-N 2.94Å; R410-S413 VanDerWaalsContact O-N 3.07Å; R410-S413 PolarHBondContact O-OG 3.47Å; R410-E414 WeakPolarHBondContact CD-OE1 3.25Å; R410-E414 HydrophobicContact CG-CG 4.17Å; R410-E414 WeakPolarHBondContact CG-OE1 3.13Å; R410-E414 WeakPolarHBondContact O-CG 3.45Å; R410-E414 PolarHBondContact O-N 3.09Å
411	Q	90.6	Very high	92.2	Very high	135 Å²	135	41.9 Å²	41.9	63%	0.631	21%	0.206	S	C	*	.	H	α-helix	trans	-58.2	-38.1	-179.3	-64.1	177.1	-10.4	0	0	111.5	S409 L415	S409-Q411 VanDerWaalsContact C-N 3.28Å; S409-Q411 PolarHBondContact O-N 2.94Å; S409-Q411 PolarHBondContact OG-N 3.17Å; Q411-L415 WeakPolarHBondContact O-CG 3.46Å; Q411-L415 PolarHBondContact O-N 3.11Å
412	I	91.5	Very high	92.2	Very high	20 Å²	20	41 Å²	41	10%	0.103	20%	0.202	C	C	.	.	H	α-helix	trans	-73.7	-39	178.1	-60.7	179.8	0	0	0	111	S409 R410 E414 L415 G416 I417 A420 V421 D422	S409-I412 PolarHBondContact O-N 2.97Å; R410-I412 PolarHBondContact O-N 3.28Å; I412-E414 VanDerWaalsContact C-N 3.32Å; I412-E414 PolarHBondContact O-N 2.78Å; I412-L415 WeakPolarHBondContact O-CB 3.49Å; I412-L415 PolarHBondContact O-N 3.47Å; I412-G416 PolarHBondContact O-N 3.33Å; I412-I417 HydrophobicContact CG2-CB 3.71Å; I412-I417 HydrophobicContact CG2-CG2 3.8Å; I412-I417 PolarHBondContact O-N 3.33Å; I412-A420 HydrophobicContact CB-CB 4.37Å; I412-A420 HydrophobicContact CG2-CB 4.29Å; I412-V421 VanDerWaalsContact CD1-O 3.22Å; I412-V421 WeakPolarHBondContact CD1-O 3.35Å; I412-D422 VanDerWaalsContact CD1-CA 3.42Å; I412-D422 HydrophobicContact CD1-CB 3.99Å
413	S	89.8	Confident	92.2	Very high	18 Å²	18	41.1 Å²	41.1	13%	0.126	20%	0.204	C	C	.	.	H	α-helix	trans	-63.7	-35.6	174.8	71.8	0	0	0	0	113	S409 R410 L415 G416 Y418	S409-S413 PolarHBondContact O-N 3.21Å; R410-S413 WeakPolarHBondContact CA-OG 3.2Å; R410-S413 PolarHBondContact O-N 2.94Å; R410-S413 VanDerWaalsContact O-N 3.07Å; R410-S413 PolarHBondContact O-OG 3.47Å; S413-L415 VanDerWaalsContact C-N 3.3Å; S413-L415 PolarHBondContact O-N 3.39Å; S413-G416 WeakPolarHBondContact O-CA 3.47Å; S413-G416 PolarHBondContact O-N 3.42Å; S413-Y418 PolarHBondContact O-OH 2.94Å
414	E	90.7	Very high	92.3	Very high	146 Å²	146	41.8 Å²	41.8	68%	0.682	21%	0.207	S	C	*	.	H	α-helix	trans	-67.6	-29.5	176	-74.1	172.1	-179.3	0	0	112.4	R410 I412 G416	R410-E414 WeakPolarHBondContact CD-OE1 3.25Å; R410-E414 HydrophobicContact CG-CG 4.17Å; R410-E414 WeakPolarHBondContact CG-OE1 3.13Å; R410-E414 WeakPolarHBondContact O-CG 3.45Å; R410-E414 PolarHBondContact O-N 3.09Å; I412-E414 VanDerWaalsContact C-N 3.32Å; I412-E414 PolarHBondContact O-N 2.78Å; E414-G416 PolarHBondContact O-N 2.88Å
415	L	90.3	Very high	92.2	Very high	111 Å²	111	45.9 Å²	45.9	58%	0.581	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-4.3	170.4	-64	172.7	0	0	0	113	Q411 I412 S413 I417	Q411-L415 WeakPolarHBondContact O-CG 3.46Å; Q411-L415 PolarHBondContact O-N 3.11Å; I412-L415 WeakPolarHBondContact O-CB 3.49Å; I412-L415 PolarHBondContact O-N 3.47Å; S413-L415 VanDerWaalsContact C-N 3.3Å; S413-L415 PolarHBondContact O-N 3.39Å; L415-I417 VanDerWaalsContact C-N 3.29Å; L415-I417 HydrophobicContact CB-CD1 4.07Å; L415-I417 HydrophobicContact CB-CG1 4.18Å; L415-I417 HydrophobicContact CD1-CD1 4.37Å; L415-I417 PolarHBondContact O-N 3.1Å
416	G	90.6	Very high	92.2	Very high	23 Å²	23	44.9 Å²	44.9	24%	0.237	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.9	18.2	-176.7	0	0	0	0	0	113.8	I412 S413 E414 Y418 Y531	I412-G416 PolarHBondContact O-N 3.33Å; S413-G416 WeakPolarHBondContact O-CA 3.47Å; S413-G416 PolarHBondContact O-N 3.42Å; E414-G416 PolarHBondContact O-N 2.88Å; G416-Y418 WeakPolarHBondContact O-CD2 3.4Å; G416-Y531 WeakPolarHBondContact O-CE2 3.44Å; G416-Y531 PolarHBondContact O-OH 2.94Å
417	I	91.3	Very high	92.2	Very high	15 Å²	15	48.6 Å²	48.6	8%	0.077	25%	0.245	C	C	.	.			trans	-91.4	120	-179.3	-64.1	171.7	0	0	0	108.9	I412 L415 Q484	I412-I417 HydrophobicContact CG2-CB 3.71Å; I412-I417 HydrophobicContact CG2-CG2 3.8Å; I412-I417 PolarHBondContact O-N 3.33Å; L415-I417 VanDerWaalsContact C-N 3.29Å; L415-I417 HydrophobicContact CB-CD1 4.07Å; L415-I417 HydrophobicContact CB-CG1 4.18Å; L415-I417 HydrophobicContact CD1-CD1 4.37Å; L415-I417 PolarHBondContact O-N 3.1Å; I417-Q484 HydrophobicContact CD1-CB 4.1Å
418	Y	91.9	Very high	92.2	Very high	102 Å²	102	48 Å²	48	40%	0.4	24%	0.242	S	C	.	.	S	Bend	trans	-125.6	134	178.9	-64.7	-80.9	0	0	0	111.1	S413 G416 S488 Q489	S413-Y418 PolarHBondContact O-OH 2.94Å; G416-Y418 WeakPolarHBondContact O-CD2 3.4Å; Y418-S488 CarbonylContact O-C 3.58Å; Y418-S488 WeakPolarHBondContact O-CA 3.24Å; Y418-S488 VanDerWaalsContact O-CB 3.26Å; Y418-S488 WeakPolarHBondContact O-CB 3.25Å; Y418-Q489 PolarHBondContact O-N 3.1Å
419	P	93.8	Very high	92.2	Very high	10 Å²	10	54.2 Å²	54.2	7%	0.065	27%	0.265	C	S	.	.	S	Bend	cis	-69	146.4	0.4	31.5	-37.4	0	0	0	112.6	I208 V210 V421 F491	I208-P419 HydrophobicContact CG2-CG 4.18Å; V210-P419 HydrophobicContact CG1-CG 3.72Å; P419-V421 HydrophobicContact CB-CG2 4.11Å; P419-V421 HydrophobicContact CG-CG2 4.32Å; P419-V421 PolarHBondContact O-N 2.97Å; P419-F491 HydrophobicContact CB-CE2 4.05Å; P419-F491 HydrophobicContact CB-CZ 3.59Å; P419-F491 HydrophobicContact CG-CE1 4.15Å; P419-F491 HydrophobicContact CG-CZ 3.63Å
420	A	92.9	Very high	92.2	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.008	26%	0.26	C	S	.	.			trans	-78.3	37.3	-174.4	0	0	0	0	0	113.3	L408 S409 I412	L408-A420 CarbonylContact C-O 3.44Å; L408-A420 WeakPolarHBondContact CA-O 3.36Å; L408-A420 HydrophobicContact CD2-CB 4.46Å; S409-A420 PolarHBondContact N-O 2.84Å; I412-A420 HydrophobicContact CB-CB 4.37Å; I412-A420 HydrophobicContact CG2-CB 4.29Å
421	V	94.6	Very high	92.3	Very high	6 Å²	6	47.1 Å²	47.1	4%	0.036	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-76.7	127.7	-176.8	177.6	0	0	0	0	109.8	V210 T406 V407 L408 I412 P419 P423 S426	V210-V421 HydrophobicContact CB-CB 4.48Å; V210-V421 HydrophobicContact CG1-CB 3.83Å; V210-V421 HydrophobicContact CG1-CG1 4.24Å; V210-V421 HydrophobicContact CG1-CG2 3.86Å; V210-V421 HydrophobicContact CG2-CB 3.8Å; V210-V421 HydrophobicContact CG2-CG1 3.65Å; T406-V421 HydrophobicContact CG2-CG1 3.93Å; T406-V421 HydrophobicContact CG2-CG2 3.9Å; V407-V421 CarbonylContact O-C 3.58Å; V407-V421 WeakPolarHBondContact O-CA 3.22Å; L408-V421 HydrophobicContact CD2-CB 4.27Å; L408-V421 HydrophobicContact CD2-CG2 3.49Å; L408-V421 VanDerWaalsContact CD2-CG2 3.49Å; I412-V421 VanDerWaalsContact CD1-O 3.22Å; I412-V421 WeakPolarHBondContact CD1-O 3.35Å; P419-V421 HydrophobicContact CB-CG2 4.11Å; P419-V421 HydrophobicContact CG-CG2 4.32Å; P419-V421 PolarHBondContact O-N 2.97Å; V421-P423 VanDerWaalsContact O-CD 3.28Å; V421-P423 WeakPolarHBondContact O-CD 3.48Å; V421-S426 WeakPolarHBondContact CG1-OG 3.39Å
422	D	94.4	Very high	92.4	Very high	14 Å²	14	42.3 Å²	42.3	8%	0.075	22%	0.218	C	C	.	.			trans	-76.2	113	172.8	-162.2	-50.8	0	0	0	110.6	V407 I412 L424 D425 S426	V407-D422 HydrophobicContact CB-CB 4.35Å; V407-D422 HydrophobicContact CG1-CB 4.44Å; V407-D422 PolarHBondContact O-N 3.05Å; I412-D422 VanDerWaalsContact CD1-CA 3.42Å; I412-D422 HydrophobicContact CD1-CB 3.99Å; D422-L424 PolarHBondContact O-N 3.38Å; D422-L424 PolarHBondContact OD1-N 2.99Å; D422-D425 HydrophobicContact CB-CB 4.12Å; D422-D425 PolarHBondContact OD1-N 3.36Å; D422-D425 VanDerWaalsContact OD1-N 3.14Å; D422-S426 WeakPolarHBondContact O-CB 3.17Å; D422-S426 PolarHBondContact O-N 2.84Å; D422-S426 VanDerWaalsContact O-N 3.07Å; D422-S426 PolarHBondContact O-OG 2.93Å
423	P	93.6	Very high	92.5	Very high	10 Å²	10	43.6 Å²	43.6	7%	0.065	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-17.9	-177.2	29.1	-35.3	0	0	0	113.9	L214 V421 L451 L487	L214-P423 HydrophobicContact CD1-CB 3.23Å; V421-P423 VanDerWaalsContact O-CD 3.28Å; V421-P423 WeakPolarHBondContact O-CD 3.48Å; P423-L451 HydrophobicContact CB-CD1 3.7Å; P423-L451 HydrophobicContact CG-CD1 3.55Å; P423-L487 HydrophobicContact CB-CD1 4.05Å; P423-L487 HydrophobicContact CG-CD1 4.2Å
424	L	93.6	Very high	92.5	Very high	39 Å²	39	51.1 Å²	51.1	20%	0.204	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-40.1	-178.3	-63.2	176.6	0	0	0	111.5	D422 L451 Q452 K455	D422-L424 PolarHBondContact O-N 3.38Å; D422-L424 PolarHBondContact OD1-N 2.99Å; L424-L451 HydrophobicContact CD2-CB 4.12Å; L424-L451 HydrophobicContact CG-CB 4.48Å; L424-Q452 HydrophobicContact CD2-CB 4.3Å; L424-K455 HydrophobicContact CD1-CD 3.96Å
425	D	92.3	Very high	92.6	Very high	88 Å²	88	46.1 Å²	46.1	47%	0.471	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-16.5	-180	-67	-18.5	0	0	0	112.7	V407 D422	V407-D425 HydrophobicContact CB-CB 4.09Å; V407-D425 HydrophobicContact CG1-CB 4.26Å; V407-D425 HydrophobicContact CG2-CB 4Å; V407-D425 WeakPolarHBondContact CG2-O 3.35Å; D422-D425 HydrophobicContact CB-CB 4.12Å; D422-D425 PolarHBondContact OD1-N 3.36Å; D422-D425 VanDerWaalsContact OD1-N 3.14Å
426	S	93.8	Very high	92.6	Very high	1 Å²	1	42 Å²	42	1%	0.007	22%	0.219	C	C	.	.			trans	-80.2	132.4	172.5	-57.6	0	0	0	0	111.4	T405 V407 V421 D422	T405-S426 CarbonylContact O-C 3.53Å; T405-S426 WeakPolarHBondContact O-CA 3.33Å; T405-S426 WeakPolarHBondContact O-CB 3.38Å; V407-S426 PolarHBondContact N-OG 3.43Å; V421-S426 WeakPolarHBondContact CG1-OG 3.39Å; D422-S426 WeakPolarHBondContact O-CB 3.17Å; D422-S426 PolarHBondContact O-N 2.84Å; D422-S426 VanDerWaalsContact O-N 3.07Å; D422-S426 PolarHBondContact O-OG 2.93Å
427	T	93.3	Very high	92.7	Very high	78 Å²	78	42.4 Å²	42.4	48%	0.479	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	154.5	-174.9	57.7	0	0	0	0	111.4	A404 T405	A404-T427 CarbonylContact C-O 3.57Å; A404-T427 WeakPolarHBondContact CA-O 3.46Å; T405-T427 PolarHBondContact N-O 3.17Å; T405-T427 PolarHBondContact O-N 2.94Å
428	S	94	Very high	92.8	Very high	17 Å²	17	48.4 Å²	48.4	12%	0.119	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	139.6	174.8	174	0	0	0	0	110.9	P216 M430 L431	P216-S428 WeakPolarHBondContact O-CB 3.33Å; P216-S428 PolarHBondContact O-OG 3.07Å; S428-M430 PolarHBondContact O-N 2.81Å; S428-M430 WeakPolarHBondContact OG-CB 3.46Å; S428-M430 PolarHBondContact OG-N 2.77Å; S428-L431 WeakPolarHBondContact O-CB 3.31Å; S428-L431 PolarHBondContact O-N 3.22Å
429	R	91.3	Very high	92.9	Very high	137 Å²	137	49.6 Å²	49.6	52%	0.517	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-23.1	170.7	-68.1	-178.7	-173.8	164	-4.1	112.2	A400 L402 D403 L431	A400-R429 PolarHBondContact O-NH2 2.71Å; L402-R429 PolarHBondContact O-NE 3.4Å; L402-R429 PolarHBondContact O-NH1 3.22Å; L402-R429 PolarHBondContact O-NH2 2.97Å; D403-R429 WeakPolarHBondContact O-CB 3.48Å; D403-R429 WeakPolarHBondContact O-CG 3.46Å; D403-R429 PolarHBondContact O-N 2.79Å; D403-R429 IonicContact OD1-CZ 2.75Å; D403-R429 IonicContact OD1-NH1 3.21Å; D403-R429 PolarHBondContact OD1-NH1 2.97Å; R429-L431 PolarHBondContact O-N 3.39Å
430	M	91.9	Very high	93	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.01	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-11.2	178.1	-60.3	-61.1	97.5	0	0	112.8	Q201 P216 Q218 S428 S432 V435 L436	Q201-M430 HydrophobicContact CB-SD 4.42Å; P216-M430 HydrophobicContact CB-CB 4.43Å; P216-M430 HydrophobicContact CG-CB 4.04Å; Q218-M430 HydrophobicContact CB-CE 4.2Å; Q218-M430 HydrophobicContact CB-CG 3.73Å; Q218-M430 HydrophobicContact CB-SD 3.79Å; Q218-M430 HydrophobicContact CG-CE 4.04Å; Q218-M430 HydrophobicContact CG-CG 4.33Å; Q218-M430 HydrophobicContact CG-SD 3.69Å; S428-M430 PolarHBondContact O-N 2.81Å; S428-M430 WeakPolarHBondContact OG-CB 3.46Å; S428-M430 PolarHBondContact OG-N 2.77Å; M430-S432 PolarHBondContact O-N 2.69Å; M430-V435 HydrophobicContact SD-CG1 4.25Å; M430-L436 WeakPolarHBondContact O-CD2 3.48Å; M430-L436 WeakPolarHBondContact O-CG 3.47Å
431	L	92.1	Very high	93.2	Very high	16 Å²	16	52.5 Å²	52.5	8%	0.084	27%	0.274	C	S	.	.			trans	-74.1	60.2	177.8	-164.8	71	0	0	0	112	S428 R429 L436 Y441 A444	S428-L431 WeakPolarHBondContact O-CB 3.31Å; S428-L431 PolarHBondContact O-N 3.22Å; R429-L431 PolarHBondContact O-N 3.39Å; L431-L436 HydrophobicContact CD1-CD1 3.74Å; L431-Y441 WeakPolarHBondContact O-CE2 3.38Å; L431-A444 HydrophobicContact CD1-CB 3.8Å
432	S	92.7	Very high	93.3	Very high	34 Å²	34	56.6 Å²	56.6	24%	0.238	30%	0.296	C	S	.	.	S	Bend	trans	-125.9	138.3	179.3	174.5	0	0	0	0	109.9	M430 H434 V435 L436	M430-S432 PolarHBondContact O-N 2.69Å; S432-H434 PolarHBondContact O-N 2.91Å; S432-H434 VanDerWaalsContact O-N 3.15Å; S432-H434 PolarHBondContact OG-N 2.97Å; S432-H434 PolarHBondContact OG-ND1 3.14Å; S432-V435 PolarHBondContact O-N 3.19Å; S432-V435 VanDerWaalsContact O-N 3.08Å; S432-L436 PolarHBondContact O-N 3.4Å
433	P	93	Very high	93.4	Very high	48 Å²	48	56 Å²	56	31%	0.312	29%	0.293	S	S	.	.	H	α-helix	trans	-62	-23.9	178.6	26.3	-34.7	0	0	0	112.7	V435 G437 Y441	P433-V435 VanDerWaalsContact C-N 3.3Å; P433-V435 PolarHBondContact O-N 2.93Å; P433-G437 CarbonylContact O-C 3.58Å; P433-G437 VanDerWaalsContact O-CA 3.24Å; P433-G437 WeakPolarHBondContact O-CA 3.42Å; P433-G437 PolarHBondContact O-N 3.37Å; P433-Y441 HydrophobicContact CB-CD1 4.3Å; P433-Y441 HydrophobicContact CB-CG 4.1Å
434	H	91.4	Very high	93.5	Very high	176 Å²	176	55.5 Å²	55.5	82%	0.815	29%	0.29	S	S	*	.	H	α-helix	trans	-70.5	-25.8	178	-57.6	83	0	0	0	113.1	S432	S432-H434 PolarHBondContact O-N 2.91Å; S432-H434 VanDerWaalsContact O-N 3.15Å; S432-H434 PolarHBondContact OG-N 2.97Å; S432-H434 PolarHBondContact OG-ND1 3.14Å
435	V	90.8	Very high	93.6	Very high	41 Å²	41	58.7 Å²	58.7	25%	0.248	30%	0.299	C	S	.	.	H	α-helix	trans	-102	-45.8	-176.9	-177.3	0	0	0	0	110.6	I203 M430 S432 P433	I203-V435 HydrophobicContact CG1-CG1 4.37Å; M430-V435 HydrophobicContact SD-CG1 4.25Å; S432-V435 PolarHBondContact O-N 3.19Å; S432-V435 VanDerWaalsContact O-N 3.08Å; P433-V435 VanDerWaalsContact C-N 3.3Å; P433-V435 PolarHBondContact O-N 2.93Å
436	L	90.6	Very high	93.8	Very high	24 Å²	24	55.4 Å²	55.4	13%	0.126	29%	0.286	C	S	.	.	H	α-helix	trans	-86.8	-20.4	-175.7	-52.7	-173.7	0	0	0	113.8	I203 P216 M430 L431 S432 H440	I203-L436 HydrophobicContact CD1-CD2 3.17Å; I203-L436 HydrophobicContact CG1-CD2 3.87Å; P216-L436 HydrophobicContact CB-CD2 4.45Å; P216-L436 HydrophobicContact CG-CD1 4.11Å; P216-L436 HydrophobicContact CG-CD2 4.03Å; M430-L436 WeakPolarHBondContact O-CD2 3.48Å; M430-L436 WeakPolarHBondContact O-CG 3.47Å; L431-L436 HydrophobicContact CD1-CD1 3.74Å; S432-L436 PolarHBondContact O-N 3.4Å; L436-H440 HydrophobicContact CB-CB 4.05Å
437	G	93	Very high	93.9	Very high	32 Å²	32	55.4 Å²	55.4	33%	0.33	29%	0.286	S	S	.	.			trans	83.5	166.2	-163.3	0	0	0	0	0	112.9	P433 Y441	P433-G437 CarbonylContact O-C 3.58Å; P433-G437 VanDerWaalsContact O-CA 3.24Å; P433-G437 WeakPolarHBondContact O-CA 3.42Å; P433-G437 PolarHBondContact O-N 3.37Å; G437-Y441 VanDerWaalsContact O-CB 3.3Å; G437-Y441 WeakPolarHBondContact O-CB 3.31Å; G437-Y441 PolarHBondContact O-N 2.71Å
438	E	94	Very high	94.1	Very high	140 Å²	140	53 Å²	53	65%	0.654	27%	0.269	S	S	*	.	H	α-helix	trans	-67.7	-41.2	-176.3	-68.4	-171.6	167.5	0	0	112.7	Y441 N442	E438-Y441 PolarHBondContact O-N 3.33Å; E438-N442 VanDerWaalsContact O-CB 3.23Å; E438-N442 WeakPolarHBondContact O-CB 3.47Å; E438-N442 PolarHBondContact O-N 2.9Å; E438-N442 PolarHBondContact O-ND2 2.84Å; E438-N442 VanDerWaalsContact O-ND2 3.1Å
439	D	94.4	Very high	94.2	Very high	127 Å²	127	58.9 Å²	58.9	68%	0.679	29%	0.293	S	S	*	.	H	α-helix	trans	-59.3	-56.5	-176	-65.2	-20.1	0	0	0	111.3	Y441 N442 T443	D439-Y441 PolarHBondContact O-N 2.7Å; D439-N442 PolarHBondContact O-N 3.45Å; D439-T443 WeakPolarHBondContact O-CB 3.46Å; D439-T443 PolarHBondContact O-N 2.84Å; D439-T443 PolarHBondContact O-OG1 2.88Å
440	H	96.1	Very high	94.4	Very high	11 Å²	11	53.5 Å²	53.5	5%	0.051	28%	0.275	C	S	.	.	H	α-helix	trans	-60.8	-46.3	179	-177	179.5	0	0	0	111	D212 L213 L436 N442 T443 A444 V511	D212-H440 PolarHBondContact O-CE1 2.87Å; D212-H440 PolarHBondContact O-NE2 3.1Å; D212-H440 VanDerWaalsContact O-NE2 3.09Å; L213-H440 PolarHBondContact O-NE2 3.47Å; L436-H440 HydrophobicContact CB-CB 4.05Å; H440-N442 PolarHBondContact O-N 3.2Å; H440-T443 PolarHBondContact O-N 2.68Å; H440-A444 WeakPolarHBondContact O-CB 3.3Å; H440-A444 PolarHBondContact O-N 3.39Å; H440-V511 HydrophobicContact CB-CG1 4.49Å; H440-V511 HydrophobicContact CB-CG2 3.99Å
441	Y	96.2	Very high	94.6	Very high	62 Å²	62	53.6 Å²	53.6	24%	0.243	28%	0.276	C	S	.	.	H	α-helix	trans	-59	-47.8	179.3	179.1	-94.8	0	0	0	112.4	L431 P433 G437 E438 D439 A444 R445	L431-Y441 WeakPolarHBondContact O-CE2 3.38Å; P433-Y441 HydrophobicContact CB-CD1 4.3Å; P433-Y441 HydrophobicContact CB-CG 4.1Å; G437-Y441 VanDerWaalsContact O-CB 3.3Å; G437-Y441 WeakPolarHBondContact O-CB 3.31Å; G437-Y441 PolarHBondContact O-N 2.71Å; E438-Y441 PolarHBondContact O-N 3.33Å; D439-Y441 PolarHBondContact O-N 2.7Å; Y441-A444 PolarHBondContact O-N 2.96Å; Y441-R445 HydrophobicContact CD1-CG 4.21Å; Y441-R445 HydrophobicContact CD2-CG 4.46Å; Y441-R445 HydrophobicContact CE1-CG 3.78Å; Y441-R445 HydrophobicContact CE2-CG 4.08Å; Y441-R445 WeakPolarHBondContact O-CB 3.41Å; Y441-R445 WeakPolarHBondContact O-CG 3.3Å; Y441-R445 PolarHBondContact O-N 2.86Å; Y441-R445 PolarHBondContact OH-NE 3.39Å
442	N	96.5	Very high	94.8	Very high	91 Å²	91	56.4 Å²	56.4	49%	0.487	29%	0.288	S	S	.	.	H	α-helix	trans	-66.1	-41.4	-178.9	-71.8	-29.6	0	0	0	111.6	E438 D439 H440 R445 G446	E438-N442 VanDerWaalsContact O-CB 3.23Å; E438-N442 WeakPolarHBondContact O-CB 3.47Å; E438-N442 PolarHBondContact O-N 2.9Å; E438-N442 PolarHBondContact O-ND2 2.84Å; E438-N442 VanDerWaalsContact O-ND2 3.1Å; D439-N442 PolarHBondContact O-N 3.45Å; H440-N442 PolarHBondContact O-N 3.2Å; N442-R445 PolarHBondContact O-N 3.05Å; N442-G446 PolarHBondContact O-N 3.49Å
443	T	96.3	Very high	94.9	Very high	2 Å²	2	57.8 Å²	57.8	1%	0.012	29%	0.293	C	S	.	.	H	α-helix	trans	-62.1	-46.9	174.8	-56.6	0	0	0	0	111.2	L213 D439 H440 R445 G446 V447 F514 Q515 L518	L213-T443 HydrophobicContact CD1-CG2 4.15Å; D439-T443 WeakPolarHBondContact O-CB 3.46Å; D439-T443 PolarHBondContact O-N 2.84Å; D439-T443 PolarHBondContact O-OG1 2.88Å; H440-T443 PolarHBondContact O-N 2.68Å; T443-R445 PolarHBondContact O-N 3.48Å; T443-G446 PolarHBondContact O-N 2.85Å; T443-V447 WeakPolarHBondContact O-CG2 3.35Å; T443-V447 PolarHBondContact O-N 3.14Å; T443-F514 HydrophobicContact CG2-CB 3.54Å; T443-Q515 HydrophobicContact CG2-CB 4.24Å; T443-Q515 PolarHBondContact OG1-OE1 3.3Å; T443-L518 HydrophobicContact CG2-CD1 4.19Å
444	A	95.9	Very high	95.1	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62	-44.9	179.2	0	0	0	0	0	112.1	L213 L214 L431 H440 Y441 V447 Q448	L213-A444 HydrophobicContact CG-CB 4.42Å; L213-A444 WeakPolarHBondContact O-CB 3.42Å; L214-A444 HydrophobicContact CD2-CB 4.15Å; L431-A444 HydrophobicContact CD1-CB 3.8Å; H440-A444 WeakPolarHBondContact O-CB 3.3Å; H440-A444 PolarHBondContact O-N 3.39Å; Y441-A444 PolarHBondContact O-N 2.96Å; A444-V447 PolarHBondContact O-N 2.77Å; A444-Q448 WeakPolarHBondContact O-CG 3.28Å; A444-Q448 PolarHBondContact O-N 3.46Å
445	R	96.3	Very high	95.1	Very high	105 Å²	105	52.7 Å²	52.7	40%	0.396	26%	0.263	S	S	.	.	H	α-helix	trans	-65.7	-37.7	175.6	-69.1	-57.9	-175.8	-175	1.3	112.6	Y441 N442 T443 Q448 K449	Y441-R445 HydrophobicContact CD1-CG 4.21Å; Y441-R445 HydrophobicContact CD2-CG 4.46Å; Y441-R445 HydrophobicContact CE1-CG 3.78Å; Y441-R445 HydrophobicContact CE2-CG 4.08Å; Y441-R445 WeakPolarHBondContact O-CB 3.41Å; Y441-R445 WeakPolarHBondContact O-CG 3.3Å; Y441-R445 PolarHBondContact O-N 2.86Å; Y441-R445 PolarHBondContact OH-NE 3.39Å; N442-R445 PolarHBondContact O-N 3.05Å; T443-R445 PolarHBondContact O-N 3.48Å; R445-Q448 PolarHBondContact O-N 3.45Å; R445-K449 WeakPolarHBondContact O-CB 3.43Å; R445-K449 PolarHBondContact O-N 3.26Å
446	G	96.2	Very high	95.3	Very high	20 Å²	20	55 Å²	55	21%	0.206	27%	0.274	C	S	.	.	H	α-helix	trans	-61.2	-46.3	173.8	0	0	0	0	0	111.9	N442 T443 K449 V450	N442-G446 PolarHBondContact O-N 3.49Å; T443-G446 PolarHBondContact O-N 2.85Å; G446-K449 PolarHBondContact O-N 2.95Å; G446-V450 WeakPolarHBondContact O-CG2 3.32Å; G446-V450 PolarHBondContact O-N 3.11Å
447	V	96.4	Very high	95.5	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60.1	-49	175.3	166.8	0	0	0	0	111.2	L213 L214 T443 A444 K449 V450 L451 I483 F514 L518	L213-V447 HydrophobicContact CD2-CG2 4.19Å; L214-V447 HydrophobicContact CD1-CG1 4.43Å; L214-V447 HydrophobicContact CD2-CB 4.32Å; L214-V447 HydrophobicContact CD2-CG1 4.01Å; T443-V447 WeakPolarHBondContact O-CG2 3.35Å; T443-V447 PolarHBondContact O-N 3.14Å; A444-V447 PolarHBondContact O-N 2.77Å; V447-K449 VanDerWaalsContact C-N 3.31Å; V447-K449 PolarHBondContact O-N 2.71Å; V447-V450 PolarHBondContact O-N 3.24Å; V447-L451 HydrophobicContact CG1-CD1 3.77Å; V447-L451 HydrophobicContact CG1-CG 4.47Å; V447-L451 WeakPolarHBondContact O-CG 3.19Å; V447-L451 PolarHBondContact O-N 3.36Å; V447-I483 HydrophobicContact CG1-CG2 3.75Å; V447-F514 HydrophobicContact CG2-CB 4.14Å; V447-F514 HydrophobicContact CG2-CD1 3.81Å; V447-F514 HydrophobicContact CG2-CG 4.26Å; V447-L518 HydrophobicContact CG2-CD1 4.16Å; V447-L518 HydrophobicContact CG2-CD2 4.29Å; V447-L518 HydrophobicContact CG2-CG 4.35Å
448	Q	96.1	Very high	95.4	Very high	27 Å²	27	56.7 Å²	56.7	13%	0.126	27%	0.273	C	S	.	.	H	α-helix	trans	-58.2	-42.9	177	-74.7	179.6	-25.2	0	0	112	L214 A444 R445 L451 Q452	L214-Q448 HydrophobicContact CD2-CG 4.18Å; A444-Q448 WeakPolarHBondContact O-CG 3.28Å; A444-Q448 PolarHBondContact O-N 3.46Å; R445-Q448 PolarHBondContact O-N 3.45Å; Q448-L451 PolarHBondContact O-N 3.04Å; Q448-Q452 WeakPolarHBondContact O-CB 3.22Å; Q448-Q452 PolarHBondContact O-N 3.27Å
449	K	96.5	Very high	95.3	Very high	141 Å²	141	55.7 Å²	55.7	61%	0.613	27%	0.272	S	S	*	.	H	α-helix	trans	-62	-45.8	178.6	-175.2	179.7	179.4	-177.2	0	112	R445 G446 V447 L451 Q452 N453	R445-K449 WeakPolarHBondContact O-CB 3.43Å; R445-K449 PolarHBondContact O-N 3.26Å; G446-K449 PolarHBondContact O-N 2.95Å; V447-K449 VanDerWaalsContact C-N 3.31Å; V447-K449 PolarHBondContact O-N 2.71Å; K449-L451 VanDerWaalsContact C-N 3.34Å; K449-L451 PolarHBondContact O-N 2.87Å; K449-Q452 PolarHBondContact O-N 3.18Å; K449-N453 WeakPolarHBondContact O-CB 3.47Å; K449-N453 PolarHBondContact O-N 3.1Å; K449-N453 PolarHBondContact O-OD1 2.95Å
450	V	96.5	Very high	95.1	Very high	24 Å²	24	53.1 Å²	53.1	15%	0.145	26%	0.258	C	S	.	.	H	α-helix	trans	-62.5	-43.6	178.2	172.4	0	0	0	0	110.9	G446 V447 N453 Y454 T476 R479 A480 I483 L518	G446-V450 WeakPolarHBondContact O-CG2 3.32Å; G446-V450 PolarHBondContact O-N 3.11Å; V447-V450 PolarHBondContact O-N 3.24Å; V450-N453 PolarHBondContact O-N 3.04Å; V450-Y454 WeakPolarHBondContact O-CB 3.11Å; V450-Y454 PolarHBondContact O-N 3.09Å; V450-T476 HydrophobicContact CG1-CG2 4.49Å; V450-R479 HydrophobicContact CG1-CB 4.35Å; V450-A480 HydrophobicContact CG1-CB 3.84Å; V450-I483 HydrophobicContact CB-CD1 4.14Å; V450-I483 HydrophobicContact CG1-CD1 3.83Å; V450-L518 HydrophobicContact CG2-CD2 3.8Å
451	L	95.9	Very high	94.9	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-67.4	-38.8	178.8	-67.8	171.7	0	0	0	112.8	P423 L424 V447 Q448 K449 Y454 K455 A480 I483 Q484 L487	P423-L451 HydrophobicContact CB-CD1 3.7Å; P423-L451 HydrophobicContact CG-CD1 3.55Å; L424-L451 HydrophobicContact CD2-CB 4.12Å; L424-L451 HydrophobicContact CG-CB 4.48Å; V447-L451 HydrophobicContact CG1-CD1 3.77Å; V447-L451 HydrophobicContact CG1-CG 4.47Å; V447-L451 WeakPolarHBondContact O-CG 3.19Å; V447-L451 PolarHBondContact O-N 3.36Å; Q448-L451 PolarHBondContact O-N 3.04Å; K449-L451 VanDerWaalsContact C-N 3.34Å; K449-L451 PolarHBondContact O-N 2.87Å; L451-Y454 PolarHBondContact O-N 3.38Å; L451-K455 PolarHBondContact O-N 2.9Å; L451-A480 HydrophobicContact CD2-CB 4.46Å; L451-I483 HydrophobicContact CD1-CG2 4.05Å; L451-I483 HydrophobicContact CD2-CB 4.43Å; L451-I483 HydrophobicContact CD2-CG2 3.94Å; L451-I483 HydrophobicContact CG-CG2 4.09Å; L451-Q484 HydrophobicContact CD2-CG 3.57Å; L451-L487 HydrophobicContact CD1-CD1 4.25Å
452	Q	96.1	Very high	94.7	Very high	75 Å²	75	55.6 Å²	55.6	35%	0.35	29%	0.287	S	S	.	.	H	α-helix	trans	-66.9	-42.4	175.5	-175.9	59.9	54.3	0	0	111.7	L424 Q448 K449 Y454 K455 N456	L424-Q452 HydrophobicContact CD2-CB 4.3Å; Q448-Q452 WeakPolarHBondContact O-CB 3.22Å; Q448-Q452 PolarHBondContact O-N 3.27Å; K449-Q452 PolarHBondContact O-N 3.18Å; Q452-Y454 VanDerWaalsContact C-N 3.32Å; Q452-Y454 PolarHBondContact O-N 2.92Å; Q452-K455 WeakPolarHBondContact O-CB 3.48Å; Q452-K455 PolarHBondContact O-N 2.98Å; Q452-N456 PolarHBondContact NE2-OD1 3.03Å; Q452-N456 VanDerWaalsContact NE2-OD1 3.1Å; Q452-N456 PolarHBondContact O-N 2.99Å; Q452-N456 VanDerWaalsContact O-N 3.07Å; Q452-N456 PolarHBondContact O-OD1 3.32Å
453	N	95.4	Very high	94.5	Very high	64 Å²	64	57.9 Å²	57.9	34%	0.342	30%	0.298	S	S	.	.	H	α-helix	trans	-61	-44.3	175.1	-73.3	-3	0	0	0	110.8	K449 V450 K455 N456 L457 T476	K449-N453 WeakPolarHBondContact O-CB 3.47Å; K449-N453 PolarHBondContact O-N 3.1Å; K449-N453 PolarHBondContact O-OD1 2.95Å; V450-N453 PolarHBondContact O-N 3.04Å; N453-K455 VanDerWaalsContact C-N 3.35Å; N453-K455 PolarHBondContact O-N 3.02Å; N453-N456 PolarHBondContact O-N 3.06Å; N453-L457 VanDerWaalsContact O-CG 3.32Å; N453-L457 WeakPolarHBondContact O-CG 3.46Å; N453-L457 PolarHBondContact O-N 3.01Å; N453-T476 HydrophobicContact CB-CG2 3.86Å
454	Y	95.5	Very high	94.3	Very high	27 Å²	27	63.1 Å²	63.1	11%	0.106	33%	0.325	C	S	.	.	H	α-helix	trans	-58.7	-44.6	174.7	171.8	-123.3	0	0	0	112.4	V450 L451 Q452 N456 L457 Q458 V477 A480 R481	V450-Y454 WeakPolarHBondContact O-CB 3.11Å; V450-Y454 PolarHBondContact O-N 3.09Å; L451-Y454 PolarHBondContact O-N 3.38Å; Q452-Y454 VanDerWaalsContact C-N 3.32Å; Q452-Y454 PolarHBondContact O-N 2.92Å; Y454-N456 VanDerWaalsContact C-N 3.29Å; Y454-N456 PolarHBondContact O-N 2.79Å; Y454-L457 CarbonylContact O-C 3.58Å; Y454-L457 PolarHBondContact O-N 3.24Å; Y454-Q458 HydrophobicContact CD2-CG 4.2Å; Y454-Q458 HydrophobicContact CE1-CG 4.24Å; Y454-Q458 HydrophobicContact CE2-CG 3.8Å; Y454-Q458 WeakPolarHBondContact O-CG 3.47Å; Y454-Q458 PolarHBondContact O-N 2.92Å; Y454-Q458 PolarHBondContact OH-NE2 3.28Å; Y454-V477 HydrophobicContact CD2-CB 4.32Å; Y454-V477 HydrophobicContact CD2-CG1 4.11Å; Y454-V477 HydrophobicContact CD2-CG2 4.06Å; Y454-V477 HydrophobicContact CE2-CG1 3.9Å; Y454-A480 HydrophobicContact CD1-CB 3.86Å; Y454-A480 HydrophobicContact CD2-CB 4.18Å; Y454-A480 HydrophobicContact CG-CB 3.52Å; Y454-R481 HydrophobicContact CE2-CG 4.37Å
455	K	93.2	Very high	94.1	Very high	90 Å²	90	64.4 Å²	64.4	39%	0.391	34%	0.339	S	S	.	.	H	α-helix	trans	-57.1	-41.3	175.4	-171.2	172.9	-178.7	173.6	0	112.1	L424 L451 Q452 N453 L457 Q458	L424-K455 HydrophobicContact CD1-CD 3.96Å; L451-K455 PolarHBondContact O-N 2.9Å; Q452-K455 WeakPolarHBondContact O-CB 3.48Å; Q452-K455 PolarHBondContact O-N 2.98Å; N453-K455 VanDerWaalsContact C-N 3.35Å; N453-K455 PolarHBondContact O-N 3.02Å; K455-L457 VanDerWaalsContact C-N 3.35Å; K455-Q458 PolarHBondContact O-N 3.01Å
456	N	93.6	Very high	93.8	Very high	89 Å²	89	64 Å²	64	48%	0.476	34%	0.342	S	S	.	.	H	α-helix	trans	-67.9	-34.8	176.1	-60.9	-13.1	0	0	0	112.4	Q452 N453 Y454	Q452-N456 PolarHBondContact NE2-OD1 3.03Å; Q452-N456 VanDerWaalsContact NE2-OD1 3.1Å; Q452-N456 PolarHBondContact O-N 2.99Å; Q452-N456 VanDerWaalsContact O-N 3.07Å; Q452-N456 PolarHBondContact O-OD1 3.32Å; N453-N456 PolarHBondContact O-N 3.06Å; Y454-N456 VanDerWaalsContact C-N 3.29Å; Y454-N456 PolarHBondContact O-N 2.79Å
457	L	94.7	Very high	93.6	Very high	15 Å²	15	69.7 Å²	69.7	8%	0.079	37%	0.368	C	S	.	.	H	α-helix	trans	-75.5	-23.6	178	-67.6	172.6	0	0	0	112.6	N453 Y454 K455 D459 I460 I461 L469 D473 T476 V477	N453-L457 VanDerWaalsContact O-CG 3.32Å; N453-L457 WeakPolarHBondContact O-CG 3.46Å; N453-L457 PolarHBondContact O-N 3.01Å; Y454-L457 CarbonylContact O-C 3.58Å; Y454-L457 PolarHBondContact O-N 3.24Å; K455-L457 VanDerWaalsContact C-N 3.35Å; L457-D459 VanDerWaalsContact C-N 3.3Å; L457-D459 PolarHBondContact O-N 2.91Å; L457-I460 HydrophobicContact CD2-CD1 4.21Å; L457-I460 WeakPolarHBondContact O-CB 3.27Å; L457-I460 PolarHBondContact O-N 3.09Å; L457-I460 VanDerWaalsContact O-N 3.11Å; L457-I461 HydrophobicContact CB-CD1 4.31Å; L457-I461 VanDerWaalsContact O-CG1 3.24Å; L457-I461 WeakPolarHBondContact O-CG1 2.95Å; L457-I461 PolarHBondContact O-N 3.32Å; L457-L469 HydrophobicContact CD2-CD2 3.98Å; L457-D473 HydrophobicContact CD1-CB 3.89Å; L457-D473 HydrophobicContact CD2-CB 4.17Å; L457-T476 HydrophobicContact CD1-CG2 4.39Å; L457-V477 HydrophobicContact CB-CG2 4.31Å; L457-V477 HydrophobicContact CD1-CG2 3.84Å
458	Q	92.5	Very high	93.4	Very high	76 Å²	76	76.5 Å²	76.5	36%	0.355	40%	0.4	S	S	.	.	H	α-helix	trans	-58.3	-40.6	179.7	-79.8	179	-34.4	0	0	112.8	Y454 K455 I460 I461 A462	Y454-Q458 HydrophobicContact CD2-CG 4.2Å; Y454-Q458 HydrophobicContact CE1-CG 4.24Å; Y454-Q458 HydrophobicContact CE2-CG 3.8Å; Y454-Q458 WeakPolarHBondContact O-CG 3.47Å; Y454-Q458 PolarHBondContact O-N 2.92Å; Y454-Q458 PolarHBondContact OH-NE2 3.28Å; K455-Q458 PolarHBondContact O-N 3.01Å; Q458-I460 VanDerWaalsContact C-N 3.3Å; Q458-I460 PolarHBondContact O-N 2.88Å; Q458-I461 PolarHBondContact O-N 3.32Å; Q458-A462 WeakPolarHBondContact O-CB 3.29Å; Q458-A462 PolarHBondContact O-N 3.06Å
459	D	90.7	Very high	93.1	Very high	119 Å²	119	75.8 Å²	75.8	64%	0.636	40%	0.397	S	S	*	.	H	α-helix	trans	-63.6	-38.7	177.1	-69.1	-24	0	0	0	111.4	L457 I463	L457-D459 VanDerWaalsContact C-N 3.3Å; L457-D459 PolarHBondContact O-N 2.91Å; D459-I463 WeakPolarHBondContact O-CG1 3.43Å; D459-I463 PolarHBondContact O-N 3.1Å
460	I	90.9	Very high	93	Very high	73 Å²	73	71.8 Å²	71.8	37%	0.374	39%	0.387	S	S	.	.	H	α-helix	trans	-67.8	-47.1	176.4	-56.9	-178.8	0	0	0	110.3	L457 Q458 A462 I463 L464 L469	L457-I460 HydrophobicContact CD2-CD1 4.21Å; L457-I460 WeakPolarHBondContact O-CB 3.27Å; L457-I460 PolarHBondContact O-N 3.09Å; L457-I460 VanDerWaalsContact O-N 3.11Å; Q458-I460 VanDerWaalsContact C-N 3.3Å; Q458-I460 PolarHBondContact O-N 2.88Å; I460-A462 VanDerWaalsContact C-N 3.27Å; I460-A462 PolarHBondContact O-N 3.47Å; I460-I463 PolarHBondContact O-N 3.38Å; I460-I463 VanDerWaalsContact O-N 3.14Å; I460-L464 HydrophobicContact CG2-CD1 3.99Å; I460-L464 PolarHBondContact O-N 2.71Å; I460-L469 HydrophobicContact CG2-CD2 3.96Å
461	I	91.1	Very high	92.8	Very high	38 Å²	38	76.7 Å²	76.7	20%	0.195	41%	0.408	C	S	.	.	H	α-helix	trans	-59.9	-39.2	178.6	-67	162.8	0	0	0	110.9	L457 Q458 I463 G465 M466 L469 V477	L457-I461 HydrophobicContact CB-CD1 4.31Å; L457-I461 VanDerWaalsContact O-CG1 3.24Å; L457-I461 WeakPolarHBondContact O-CG1 2.95Å; L457-I461 PolarHBondContact O-N 3.32Å; Q458-I461 PolarHBondContact O-N 3.32Å; I461-I463 VanDerWaalsContact C-N 3.3Å; I461-I463 PolarHBondContact O-N 2.72Å; I461-G465 VanDerWaalsContact O-CA 3.24Å; I461-G465 WeakPolarHBondContact O-CA 3.42Å; I461-G465 PolarHBondContact O-N 3.33Å; I461-M466 HydrophobicContact CG1-CG 4.42Å; I461-M466 HydrophobicContact CG2-CG 3.72Å; I461-L469 HydrophobicContact CD1-CD1 3.92Å; I461-L469 HydrophobicContact CG1-CD1 3.66Å; I461-L469 HydrophobicContact CG1-CG 4.36Å; I461-V477 HydrophobicContact CD1-CG1 4.23Å; I461-V477 HydrophobicContact CD1-CG2 3.75Å
462	A	92.3	Very high	92.6	Very high	87 Å²	87	82.1 Å²	82.1	72%	0.719	44%	0.437	S	S	*	.	H	α-helix	trans	-67.1	-28.7	179.3	0	0	0	0	0	113.2	Q458 I460	Q458-A462 WeakPolarHBondContact O-CB 3.29Å; Q458-A462 PolarHBondContact O-N 3.06Å; I460-A462 VanDerWaalsContact C-N 3.27Å; I460-A462 PolarHBondContact O-N 3.47Å
463	I	93.1	Very high	92.5	Very high	139 Å²	139	81.2 Å²	81.2	71%	0.713	44%	0.435	S	S	*	.	H	α-helix	trans	-95.3	-51.8	-177.5	-63.4	169.6	0	0	0	112	D459 I460 I461	D459-I463 WeakPolarHBondContact O-CG1 3.43Å; D459-I463 PolarHBondContact O-N 3.1Å; I460-I463 PolarHBondContact O-N 3.38Å; I460-I463 VanDerWaalsContact O-N 3.14Å; I461-I463 VanDerWaalsContact C-N 3.3Å; I461-I463 PolarHBondContact O-N 2.72Å
464	L	90.6	Very high	92.5	Very high	112 Å²	112	81.2 Å²	81.2	59%	0.586	43%	0.432	S	S	*	.	H	α-helix	trans	-97.9	-22.3	-171.5	-64.1	179.2	0	0	0	113.2	I460 E468	I460-L464 HydrophobicContact CG2-CD1 3.99Å; I460-L464 PolarHBondContact O-N 2.71Å; L464-E468 HydrophobicContact CB-CB 4.06Å; L464-E468 HydrophobicContact CB-CG 4.12Å
465	G	91.8	Very high	92.3	Very high	27 Å²	27	83.8 Å²	83.8	28%	0.278	45%	0.447	S	S	.	.			trans	90.8	170.2	-172.1	0	0	0	0	0	113.3	I461	I461-G465 VanDerWaalsContact O-CA 3.24Å; I461-G465 WeakPolarHBondContact O-CA 3.42Å; I461-G465 PolarHBondContact O-N 3.33Å
466	M	90.8	Very high	92.4	Very high	97 Å²	97	81 Å²	81	48%	0.478	44%	0.438	S	S	.	.	S	Bend	trans	-74.7	-23.9	-177.4	-66.6	-165.9	-55.1	0	0	113.6	I461 E468 L469 K474	I461-M466 HydrophobicContact CG1-CG 4.42Å; I461-M466 HydrophobicContact CG2-CG 3.72Å; M466-E468 VanDerWaalsContact C-N 3.27Å; M466-E468 PolarHBondContact O-N 3.27Å; M466-L469 WeakPolarHBondContact O-CB 3.15Å; M466-L469 PolarHBondContact O-N 2.84Å; M466-K474 WeakPolarHBondContact O-CE 3.36Å
467	D	92.1	Very high	92.4	Very high	140 Å²	140	77.2 Å²	77.2	75%	0.749	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-27.6	-173.9	-63.7	-36.3	0	0	0	112.5	L469 K474	D467-L469 VanDerWaalsContact C-N 3.3Å; D467-L469 PolarHBondContact O-N 3.21Å; D467-K474 PolarHBondContact O-NZ 3.27Å
468	E	91.1	Very high	92.4	Very high	142 Å²	142	78 Å²	78	66%	0.664	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-6.5	-179.9	-62.7	-59.9	148.1	0	0	113.8	L464 M466	L464-E468 HydrophobicContact CB-CB 4.06Å; L464-E468 HydrophobicContact CB-CG 4.12Å; M466-E468 VanDerWaalsContact C-N 3.27Å; M466-E468 PolarHBondContact O-N 3.27Å
469	L	90.9	Very high	92.5	Very high	13 Å²	13	77.5 Å²	77.5	7%	0.068	42%	0.421	C	S	.	.	S	Bend	trans	-73.9	148.7	175	-69	-176.8	0	0	0	111.2	L457 I460 I461 M466 D467 D473 K474 V477	L457-L469 HydrophobicContact CD2-CD2 3.98Å; I460-L469 HydrophobicContact CG2-CD2 3.96Å; I461-L469 HydrophobicContact CD1-CD1 3.92Å; I461-L469 HydrophobicContact CG1-CD1 3.66Å; I461-L469 HydrophobicContact CG1-CG 4.36Å; M466-L469 WeakPolarHBondContact O-CB 3.15Å; M466-L469 PolarHBondContact O-N 2.84Å; D467-L469 VanDerWaalsContact C-N 3.3Å; D467-L469 PolarHBondContact O-N 3.21Å; L469-D473 HydrophobicContact CB-CB 4.03Å; L469-D473 HydrophobicContact CD1-CB 4.39Å; L469-D473 HydrophobicContact CD2-CB 4.27Å; L469-D473 HydrophobicContact CG-CB 4.47Å; L469-K474 HydrophobicContact CB-CG 3.84Å; L469-K474 WeakPolarHBondContact O-CE 3.44Å; L469-V477 HydrophobicContact CD1-CG2 3.93Å
470	S	93.3	Very high	92.7	Very high	57 Å²	57	71.9 Å²	71.9	40%	0.399	39%	0.391	S	S	.	.			trans	-61.2	155.9	167.4	74.5	0	0	0	0	110.5	D472 D473 K474	S470-D472 PolarHBondContact O-N 3.43Å; S470-D473 PolarHBondContact O-N 2.86Å; S470-D473 VanDerWaalsContact O-N 3.09Å; S470-D473 WeakPolarHBondContact OG-CB 3.33Å; S470-D473 PolarHBondContact OG-N 2.75Å; S470-D473 VanDerWaalsContact OG-N 3.15Å; S470-D473 PolarHBondContact OG-OD2 2.79Å; S470-K474 WeakPolarHBondContact O-CG 3.36Å; S470-K474 PolarHBondContact O-N 2.79Å
471	E	93	Very high	92.9	Very high	127 Å²	127	72.4 Å²	72.4	59%	0.593	39%	0.388	S	S	*	.	H	α-helix	trans	-60.1	-34.7	178.4	-64	-57.2	121.6	0	0	111.9	K474 L475	E471-K474 PolarHBondContact O-N 3.3Å; E471-K474 IonicContact OE1-NZ 3.66Å; E471-K474 PolarHBondContact OE1-NZ 2.73Å; E471-L475 WeakPolarHBondContact O-CG 3.45Å; E471-L475 PolarHBondContact O-N 2.87Å
472	D	92.7	Very high	93.1	Very high	118 Å²	118	71 Å²	71	63%	0.631	38%	0.38	S	S	*	.	H	α-helix	trans	-66.5	-38.1	174.9	-69	-25.7	0	0	0	112.4	S470 L475 T476	S470-D472 PolarHBondContact O-N 3.43Å; D472-L475 PolarHBondContact O-N 3.41Å; D472-T476 PolarHBondContact O-N 3.32Å; D472-T476 PolarHBondContact O-OG1 3.4Å
473	D	93.9	Very high	93.2	Very high	56 Å²	56	66.9 Å²	66.9	30%	0.299	35%	0.347	S	S	.	.	H	α-helix	trans	-70.2	-39.8	175.5	-69.1	-40.5	0	0	0	111.2	L457 L469 S470 L475 T476 V477	L457-D473 HydrophobicContact CD1-CB 3.89Å; L457-D473 HydrophobicContact CD2-CB 4.17Å; L469-D473 HydrophobicContact CB-CB 4.03Å; L469-D473 HydrophobicContact CD1-CB 4.39Å; L469-D473 HydrophobicContact CD2-CB 4.27Å; L469-D473 HydrophobicContact CG-CB 4.47Å; S470-D473 PolarHBondContact O-N 2.86Å; S470-D473 VanDerWaalsContact O-N 3.09Å; S470-D473 WeakPolarHBondContact OG-CB 3.33Å; S470-D473 PolarHBondContact OG-N 2.75Å; S470-D473 VanDerWaalsContact OG-N 3.15Å; S470-D473 PolarHBondContact OG-OD2 2.79Å; D473-L475 VanDerWaalsContact C-N 3.31Å; D473-L475 PolarHBondContact O-N 3.3Å; D473-T476 WeakPolarHBondContact O-CB 3.11Å; D473-T476 PolarHBondContact O-N 3.43Å; D473-T476 VanDerWaalsContact O-N 3.15Å; D473-V477 VanDerWaalsContact O-CG2 3.25Å; D473-V477 WeakPolarHBondContact O-CG2 3.41Å; D473-V477 PolarHBondContact O-N 3.33Å
474	K	93.7	Very high	93.3	Very high	63 Å²	63	62.2 Å²	62.2	27%	0.274	32%	0.322	S	S	.	.	H	α-helix	trans	-58.5	-44.3	173	-71.3	175.8	-174.7	162.7	0	111.1	M466 D467 L469 S470 E471 V477 A478	M466-K474 WeakPolarHBondContact O-CE 3.36Å; D467-K474 PolarHBondContact O-NZ 3.27Å; L469-K474 HydrophobicContact CB-CG 3.84Å; L469-K474 WeakPolarHBondContact O-CE 3.44Å; S470-K474 WeakPolarHBondContact O-CG 3.36Å; S470-K474 PolarHBondContact O-N 2.79Å; E471-K474 PolarHBondContact O-N 3.3Å; E471-K474 IonicContact OE1-NZ 3.66Å; E471-K474 PolarHBondContact OE1-NZ 2.73Å; K474-V477 PolarHBondContact O-N 2.85Å; K474-A478 WeakPolarHBondContact O-CB 3.3Å; K474-A478 PolarHBondContact O-N 2.9Å
475	L	93.2	Very high	93.5	Very high	82 Å²	82	60 Å²	60	43%	0.429	31%	0.305	S	S	.	.	H	α-helix	trans	-62.6	-42.1	174.3	-72.3	174.2	0	0	0	111.8	E471 D472 D473 V477 A478 R479	E471-L475 WeakPolarHBondContact O-CG 3.45Å; E471-L475 PolarHBondContact O-N 2.87Å; D472-L475 PolarHBondContact O-N 3.41Å; D473-L475 VanDerWaalsContact C-N 3.31Å; D473-L475 PolarHBondContact O-N 3.3Å; L475-V477 VanDerWaalsContact C-N 3.35Å; L475-V477 PolarHBondContact O-N 3.06Å; L475-A478 PolarHBondContact O-N 3.36Å; L475-R479 WeakPolarHBondContact O-CB 3.48Å; L475-R479 WeakPolarHBondContact O-CG 3.34Å; L475-R479 PolarHBondContact O-N 3.14Å
476	T	93.7	Very high	93.7	Very high	32 Å²	32	58.8 Å²	58.8	20%	0.196	29%	0.292	C	S	.	.	H	α-helix	trans	-60.6	-44.3	176.5	-61.4	0	0	0	0	111.6	V450 N453 L457 D472 D473 R479 A480	V450-T476 HydrophobicContact CG1-CG2 4.49Å; N453-T476 HydrophobicContact CB-CG2 3.86Å; L457-T476 HydrophobicContact CD1-CG2 4.39Å; D472-T476 PolarHBondContact O-N 3.32Å; D472-T476 PolarHBondContact O-OG1 3.4Å; D473-T476 WeakPolarHBondContact O-CB 3.11Å; D473-T476 PolarHBondContact O-N 3.43Å; D473-T476 VanDerWaalsContact O-N 3.15Å; T476-R479 PolarHBondContact O-N 3.07Å; T476-A480 VanDerWaalsContact O-CB 3.27Å; T476-A480 WeakPolarHBondContact O-CB 3.14Å; T476-A480 PolarHBondContact O-N 3.3Å
477	V	94.3	Very high	93.9	Very high	8 Å²	8	54.6 Å²	54.6	5%	0.048	27%	0.272	C	S	.	.	H	α-helix	trans	-62.4	-47.1	175.8	172	0	0	0	0	110.8	Y454 L457 I461 L469 D473 K474 L475 R479 A480 R481	Y454-V477 HydrophobicContact CD2-CB 4.32Å; Y454-V477 HydrophobicContact CD2-CG1 4.11Å; Y454-V477 HydrophobicContact CD2-CG2 4.06Å; Y454-V477 HydrophobicContact CE2-CG1 3.9Å; L457-V477 HydrophobicContact CB-CG2 4.31Å; L457-V477 HydrophobicContact CD1-CG2 3.84Å; I461-V477 HydrophobicContact CD1-CG1 4.23Å; I461-V477 HydrophobicContact CD1-CG2 3.75Å; L469-V477 HydrophobicContact CD1-CG2 3.93Å; D473-V477 VanDerWaalsContact O-CG2 3.25Å; D473-V477 WeakPolarHBondContact O-CG2 3.41Å; D473-V477 PolarHBondContact O-N 3.33Å; K474-V477 PolarHBondContact O-N 2.85Å; L475-V477 VanDerWaalsContact C-N 3.35Å; L475-V477 PolarHBondContact O-N 3.06Å; V477-R479 PolarHBondContact O-N 3.2Å; V477-A480 PolarHBondContact O-N 3.01Å; V477-R481 HydrophobicContact CG1-CG 4.48Å; V477-R481 VanDerWaalsContact O-CG 3.29Å; V477-R481 WeakPolarHBondContact O-CG 3.21Å; V477-R481 PolarHBondContact O-N 2.91Å
478	A	93.8	Very high	94	Very high	31 Å²	31	47.9 Å²	47.9	26%	0.256	24%	0.236	S	C	.	.	H	α-helix	trans	-59.7	-46	178.4	0	0	0	0	0	111.7	K474 L475 R481 K482	K474-A478 WeakPolarHBondContact O-CB 3.3Å; K474-A478 PolarHBondContact O-N 2.9Å; L475-A478 PolarHBondContact O-N 3.36Å; A478-R481 PolarHBondContact O-N 3.18Å; A478-K482 WeakPolarHBondContact O-CG 3.43Å; A478-K482 PolarHBondContact O-N 3.48Å; A478-K482 VanDerWaalsContact O-N 3.14Å
479	R	95.4	Very high	94.1	Very high	67 Å²	67	41.2 Å²	41.2	25%	0.253	21%	0.205	S	C	.	.	H	α-helix	trans	-65	-43.3	176.2	-72.6	-175.7	-172.9	167.3	8.7	112.1	V450 L475 T476 V477 R481 K482 I483 L518 D523	V450-R479 HydrophobicContact CG1-CB 4.35Å; L475-R479 WeakPolarHBondContact O-CB 3.48Å; L475-R479 WeakPolarHBondContact O-CG 3.34Å; L475-R479 PolarHBondContact O-N 3.14Å; T476-R479 PolarHBondContact O-N 3.07Å; V477-R479 PolarHBondContact O-N 3.2Å; R479-R481 PolarHBondContact O-N 2.98Å; R479-K482 WeakPolarHBondContact O-CB 3.32Å; R479-K482 PolarHBondContact O-N 3.31Å; R479-I483 VanDerWaalsContact O-CG1 3.31Å; R479-I483 WeakPolarHBondContact O-CG1 3.42Å; R479-I483 PolarHBondContact O-N 3.45Å; R479-L518 PolarHBondContact NH1-O 2.8Å; R479-D523 WeakPolarHBondContact CG-OD1 3.22Å; R479-D523 IonicContact CZ-OD2 3.43Å; R479-D523 IonicContact NE-OD1 2.76Å; R479-D523 PolarHBondContact NE-OD1 3.31Å; R479-D523 VanDerWaalsContact NE-OD1 3.16Å; R479-D523 IonicContact NE-OD2 3.76Å; R479-D523 PolarHBondContact NE-OD2 2.93Å; R479-D523 IonicContact NH2-OD2 2.69Å; R479-D523 PolarHBondContact NH2-OD2 3.46Å
480	A	95.1	Very high	94.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.7	-43.1	177.9	0	0	0	0	0	112.2	V450 L451 Y454 T476 V477 K482 I483 Q484	V450-A480 HydrophobicContact CG1-CB 3.84Å; L451-A480 HydrophobicContact CD2-CB 4.46Å; Y454-A480 HydrophobicContact CD1-CB 3.86Å; Y454-A480 HydrophobicContact CD2-CB 4.18Å; Y454-A480 HydrophobicContact CG-CB 3.52Å; T476-A480 VanDerWaalsContact O-CB 3.27Å; T476-A480 WeakPolarHBondContact O-CB 3.14Å; T476-A480 PolarHBondContact O-N 3.3Å; V477-A480 PolarHBondContact O-N 3.01Å; A480-K482 VanDerWaalsContact C-N 3.31Å; A480-K482 PolarHBondContact O-N 3.44Å; A480-I483 PolarHBondContact O-N 3.16Å; A480-Q484 WeakPolarHBondContact O-CG 3.39Å; A480-Q484 PolarHBondContact O-N 2.67Å
481	R	94.5	Very high	94.2	Very high	84 Å²	84	38.6 Å²	38.6	32%	0.317	19%	0.186	S	C	.	.	H	α-helix	trans	-65.2	-33.4	176.7	-69.8	175.8	100.6	-160.3	18	112.8	Y454 V477 A478 R479 R485 E527	Y454-R481 HydrophobicContact CE2-CG 4.37Å; V477-R481 HydrophobicContact CG1-CG 4.48Å; V477-R481 VanDerWaalsContact O-CG 3.29Å; V477-R481 WeakPolarHBondContact O-CG 3.21Å; V477-R481 PolarHBondContact O-N 2.91Å; A478-R481 PolarHBondContact O-N 3.18Å; R479-R481 PolarHBondContact O-N 2.98Å; R481-R485 PolarHBondContact O-N 3.01Å; R481-R485 PolarHBondContact O-NH1 2.76Å; R481-E527 IonicContact CZ-OE1 3.84Å; R481-E527 IonicContact CZ-OE2 2.88Å; R481-E527 IonicContact NE-OE1 2.71Å; R481-E527 IonicContact NE-OE2 3.7Å; R481-E527 IonicContact NH1-OE1 3.62Å; R481-E527 PolarHBondContact NH1-OE1 2.84Å; R481-E527 IonicContact NH1-OE2 3.39Å; R481-E527 PolarHBondContact NH1-OE2 2.91Å
482	K	95.5	Very high	93.9	Very high	9 Å²	9	34.9 Å²	34.9	4%	0.039	17%	0.169	C	C	.	.	H	α-helix	trans	-68	-47.9	171.5	-71.4	172.8	178.3	-172.6	0	111.2	A478 R479 A480 Q484 R485 F486 Y522 D523 L525 E527 F530	A478-K482 WeakPolarHBondContact O-CG 3.43Å; A478-K482 PolarHBondContact O-N 3.48Å; A478-K482 VanDerWaalsContact O-N 3.14Å; R479-K482 WeakPolarHBondContact O-CB 3.32Å; R479-K482 PolarHBondContact O-N 3.31Å; A480-K482 VanDerWaalsContact C-N 3.31Å; A480-K482 PolarHBondContact O-N 3.44Å; K482-Q484 PolarHBondContact O-N 3.47Å; K482-R485 PolarHBondContact O-N 3.12Å; K482-F486 VanDerWaalsContact O-CB 3.29Å; K482-F486 WeakPolarHBondContact O-CB 3.17Å; K482-F486 PolarHBondContact O-N 3.33Å; K482-Y522 PolarHBondContact NZ-O 2.87Å; K482-D523 VanDerWaalsContact NZ-CA 3.26Å; K482-D523 PolarHBondContact NZ-O 2.79Å; K482-L525 WeakPolarHBondContact CE-O 3.37Å; K482-L525 PolarHBondContact NZ-O 3.19Å; K482-E527 HydrophobicContact CG-CG 4.2Å; K482-F530 HydrophobicContact CB-CD1 4.45Å; K482-F530 HydrophobicContact CB-CD2 4.01Å; K482-F530 HydrophobicContact CB-CE2 4.11Å; K482-F530 HydrophobicContact CB-CG 4.18Å; K482-F530 HydrophobicContact CB-CZ 4.35Å; K482-F530 HydrophobicContact CD-CD2 4.25Å; K482-F530 HydrophobicContact CD-CE2 3.68Å; K482-F530 HydrophobicContact CD-CZ 4.08Å; K482-F530 HydrophobicContact CG-CD2 3.82Å; K482-F530 HydrophobicContact CG-CE2 3.79Å; K482-F530 HydrophobicContact CG-CG 4.47Å; K482-F530 HydrophobicContact CG-CZ 4.4Å
483	I	95.8	Very high	93.5	Very high	1 Å²	1	30 Å²	30	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-58.6	-48.1	177.3	-71.1	170.6	0	0	0	110.9	V447 V450 L451 R479 A480 R485 F486 L487 F514 V517 L518	V447-I483 HydrophobicContact CG1-CG2 3.75Å; V450-I483 HydrophobicContact CB-CD1 4.14Å; V450-I483 HydrophobicContact CG1-CD1 3.83Å; L451-I483 HydrophobicContact CD1-CG2 4.05Å; L451-I483 HydrophobicContact CD2-CB 4.43Å; L451-I483 HydrophobicContact CD2-CG2 3.94Å; L451-I483 HydrophobicContact CG-CG2 4.09Å; R479-I483 VanDerWaalsContact O-CG1 3.31Å; R479-I483 WeakPolarHBondContact O-CG1 3.42Å; R479-I483 PolarHBondContact O-N 3.45Å; A480-I483 PolarHBondContact O-N 3.16Å; I483-R485 VanDerWaalsContact C-N 3.29Å; I483-R485 PolarHBondContact O-N 3.41Å; I483-F486 CarbonylContact O-C 3.44Å; I483-F486 PolarHBondContact O-N 2.96Å; I483-L487 HydrophobicContact CG2-CD1 4.2Å; I483-L487 HydrophobicContact CG2-CG 4.47Å; I483-L487 WeakPolarHBondContact O-CG 3.47Å; I483-L487 PolarHBondContact O-N 3.42Å; I483-F514 HydrophobicContact CG2-CE1 4.25Å; I483-V517 HydrophobicContact CD1-CG1 4.3Å; I483-V517 HydrophobicContact CG1-CG1 3.76Å; I483-L518 HydrophobicContact CD1-CD2 4.14Å
484	Q	94.3	Very high	93	Very high	41 Å²	41	27.9 Å²	27.9	19%	0.192	13%	0.134	C	C	.	.	H	α-helix	trans	-56	-43.8	178.5	-77.4	-173	-33.4	0	0	112	I417 L451 A480 K482	I417-Q484 HydrophobicContact CD1-CB 4.1Å; L451-Q484 HydrophobicContact CD2-CG 3.57Å; A480-Q484 WeakPolarHBondContact O-CG 3.39Å; A480-Q484 PolarHBondContact O-N 2.67Å; K482-Q484 PolarHBondContact O-N 3.47Å
485	R	94.6	Very high	92.5	Very high	65 Å²	65	29.5 Å²	29.5	25%	0.245	14%	0.142	C	C	.	.	H	α-helix	trans	-71.1	-37.2	175	-70.4	-176.7	-178.4	95.9	-11.9	111.9	R481 K482 I483 L487 S488 E527 F530	R481-R485 PolarHBondContact O-N 3.01Å; R481-R485 PolarHBondContact O-NH1 2.76Å; K482-R485 PolarHBondContact O-N 3.12Å; I483-R485 VanDerWaalsContact C-N 3.29Å; I483-R485 PolarHBondContact O-N 3.41Å; R485-L487 PolarHBondContact O-N 2.87Å; R485-S488 VanDerWaalsContact O-CB 3.23Å; R485-S488 WeakPolarHBondContact O-CB 3.07Å; R485-S488 PolarHBondContact O-N 3.46Å; R485-S488 PolarHBondContact O-OG 3.09Å; R485-E527 WeakPolarHBondContact CD-O 3.48Å; R485-E527 IonicContact CZ-OE2 2.7Å; R485-E527 IonicContact NH1-OE2 2.8Å; R485-E527 PolarHBondContact NH1-OE2 3.46Å; R485-E527 IonicContact NH2-OE2 3.9Å; R485-E527 PolarHBondContact NH2-OE2 3.12Å; R485-F530 CarbonylContact C-O 3.56Å; R485-F530 VanDerWaalsContact C-O 3.22Å; R485-F530 HydrophobicContact CB-CB 4.11Å
486	F	95.9	Very high	91.7	Very high	1 Å²	1	31.4 Å²	31.4	0%	0.004	16%	0.157	C	C	.	.	H	α-helix	trans	-68.5	-23	179.5	-164.8	-133.6	0	0	0	113.5	K209 K482 I483 S488 F514 F530 V533 V539	K209-F486 WeakPolarHBondContact CE-O 3.46Å; K209-F486 PolarHBondContact NZ-O 3.39Å; K482-F486 VanDerWaalsContact O-CB 3.29Å; K482-F486 WeakPolarHBondContact O-CB 3.17Å; K482-F486 PolarHBondContact O-N 3.33Å; I483-F486 CarbonylContact O-C 3.44Å; I483-F486 PolarHBondContact O-N 2.96Å; F486-S488 PolarHBondContact O-N 3.2Å; F486-F514 HydrophobicContact CB-CE1 4.35Å; F486-F514 HydrophobicContact CB-CZ 4.48Å; F486-F514 AromaticContact CD1-CD1 3.87Å; F486-F514 HydrophobicContact CD1-CD1 3.87Å; F486-F514 HydrophobicContact CD1-CD2 4.28Å; F486-F514 AromaticContact CD1-CE1 3.45Å; F486-F514 HydrophobicContact CD1-CE1 3.45Å; F486-F514 VanDerWaalsContact CD1-CE1 3.45Å; F486-F514 AromaticContact CD1-CE2 3.88Å; F486-F514 HydrophobicContact CD1-CE2 3.88Å; F486-F514 HydrophobicContact CD1-CG 4.26Å; F486-F514 AromaticContact CD1-CZ 3.43Å; F486-F514 HydrophobicContact CD1-CZ 3.43Å; F486-F514 VanDerWaalsContact CD1-CZ 3.43Å; F486-F514 HydrophobicContact CE1-CD1 4.32Å; F486-F514 HydrophobicContact CE1-CD2 4.03Å; F486-F514 HydrophobicContact CE1-CE1 4.17Å; F486-F514 AromaticContact CE1-CE2 3.85Å; F486-F514 HydrophobicContact CE1-CE2 3.85Å; F486-F514 HydrophobicContact CE1-CG 4.25Å; F486-F514 AromaticContact CE1-CZ 3.91Å; F486-F514 HydrophobicContact CE1-CZ 3.91Å; F486-F514 HydrophobicContact CG-CE1 4.31Å; F486-F514 HydrophobicContact CG-CZ 4.21Å; F486-F530 VanDerWaalsContact CA-O 3.31Å; F486-F530 WeakPolarHBondContact CA-O 3.17Å; F486-F530 HydrophobicContact CB-CB 4.09Å; F486-F530 HydrophobicContact CB-CD1 3.78Å; F486-F530 HydrophobicContact CB-CG 4.39Å; F486-F530 AromaticContact CD2-CD1 3.84Å; F486-F530 HydrophobicContact CD2-CD1 3.84Å; F486-F530 AromaticContact CG-CD1 3.82Å; F486-F530 HydrophobicContact CG-CD1 3.82Å; F486-F530 PolarHBondContact N-O 2.98Å; F486-V533 HydrophobicContact CD2-CG2 3.92Å; F486-V533 HydrophobicContact CE2-CG2 4Å; F486-V539 HydrophobicContact CD2-CG2 3.99Å; F486-V539 HydrophobicContact CE2-CG2 3.72Å
487	L	95	Very high	91	Very high	9 Å²	9	36.7 Å²	36.7	5%	0.047	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-16.8	169.9	-70.2	168.1	0	0	0	112.7	V210 L214 P423 L451 I483 R485 F514	V210-L487 HydrophobicContact CB-CB 4.47Å; V210-L487 HydrophobicContact CB-CD2 3.95Å; V210-L487 HydrophobicContact CG2-CD2 4.07Å; L214-L487 HydrophobicContact CD1-CD1 4.47Å; L214-L487 HydrophobicContact CD1-CD2 4.27Å; P423-L487 HydrophobicContact CB-CD1 4.05Å; P423-L487 HydrophobicContact CG-CD1 4.2Å; L451-L487 HydrophobicContact CD1-CD1 4.25Å; I483-L487 HydrophobicContact CG2-CD1 4.2Å; I483-L487 HydrophobicContact CG2-CG 4.47Å; I483-L487 WeakPolarHBondContact O-CG 3.47Å; I483-L487 PolarHBondContact O-N 3.42Å; R485-L487 PolarHBondContact O-N 2.87Å; L487-F514 HydrophobicContact CD2-CE1 3.88Å; L487-F514 HydrophobicContact CD2-CE2 4.43Å; L487-F514 HydrophobicContact CD2-CZ 3.53Å; L487-F514 HydrophobicContact CG-CE1 4.15Å; L487-F514 HydrophobicContact CG-CZ 4.07Å
488	S	94.3	Very high	90.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.194	C	C	.	.			trans	-68.4	149.3	169.8	72.1	0	0	0	0	111.6	K209 Y418 R485 F486 M532	K209-S488 WeakPolarHBondContact CE-O 3.45Å; K209-S488 PolarHBondContact NZ-O 3.26Å; Y418-S488 CarbonylContact O-C 3.58Å; Y418-S488 WeakPolarHBondContact O-CA 3.24Å; Y418-S488 VanDerWaalsContact O-CB 3.26Å; Y418-S488 WeakPolarHBondContact O-CB 3.25Å; R485-S488 VanDerWaalsContact O-CB 3.23Å; R485-S488 WeakPolarHBondContact O-CB 3.07Å; R485-S488 PolarHBondContact O-N 3.46Å; R485-S488 PolarHBondContact O-OG 3.09Å; F486-S488 PolarHBondContact O-N 3.2Å; S488-M532 PolarHBondContact OG-N 3.23Å
489	Q	94.3	Very high	89.8	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.009	22%	0.216	C	C	.	.			trans	-150.6	131.7	-177.3	-177.9	174	-29.5	0	0	110.4	G207 Y418 F491 K503	G207-Q489 PolarHBondContact O-NE2 3.15Å; G207-Q489 PolarHBondContact O-OE1 3.47Å; Y418-Q489 PolarHBondContact O-N 3.1Å; Q489-F491 HydrophobicContact CB-CD1 4.49Å; Q489-F491 HydrophobicContact CB-CE1 4.23Å; Q489-F491 HydrophobicContact CG-CD1 4.38Å; Q489-F491 HydrophobicContact CG-CE1 4.38Å; Q489-F491 WeakPolarHBondContact O-CD1 3.41Å; Q489-F491 PolarHBondContact O-N 3.2Å; Q489-K503 PolarHBondContact NE2-O 2.81Å
490	P	92.4	Very high	89.3	Confident	4 Å²	4	39.5 Å²	39.5	3%	0.026	22%	0.216	C	C	.	.			trans	-71	123.1	173.3	29.8	-33.6	0	0	0	110.2	A500 G502 K503 M532	P490-A500 HydrophobicContact CB-CB 4.32Å; P490-G502 WeakPolarHBondContact O-CA 3.35Å; P490-K503 HydrophobicContact CG-CB 3.96Å; P490-K503 HydrophobicContact CG-CG 3.6Å; P490-K503 PolarHBondContact O-N 2.73Å; P490-M532 HydrophobicContact CB-CE 4.02Å
491	F	92.4	Very high	89	Confident	10 Å²	10	43.1 Å²	43.1	4%	0.044	24%	0.24	C	C	.	.			trans	-91.2	145.8	179	-71.8	-3.4	0	0	0	111.5	I208 V235 L236 E239 P419 Q489 V493 A494 E495	I208-F491 HydrophobicContact CD1-CE1 4.28Å; I208-F491 HydrophobicContact CD1-CZ 3.99Å; I208-F491 HydrophobicContact CG1-CE1 4.24Å; I208-F491 HydrophobicContact CG1-CZ 4.43Å; I208-F491 HydrophobicContact CG2-CE1 4.26Å; I208-F491 HydrophobicContact CG2-CZ 4.31Å; V235-F491 HydrophobicContact CG1-CD2 3.77Å; V235-F491 HydrophobicContact CG1-CE2 4.34Å; L236-F491 HydrophobicContact CD1-CE2 4.15Å; L236-F491 HydrophobicContact CD1-CZ 4.04Å; E239-F491 HydrophobicContact CB-CB 4.34Å; E239-F491 HydrophobicContact CB-CD2 3.63Å; E239-F491 HydrophobicContact CB-CE2 3.94Å; E239-F491 HydrophobicContact CB-CG 3.96Å; E239-F491 HydrophobicContact CB-CZ 4.49Å; E239-F491 HydrophobicContact CG-CB 3.97Å; E239-F491 HydrophobicContact CG-CD1 3.76Å; E239-F491 HydrophobicContact CG-CD2 3.77Å; E239-F491 HydrophobicContact CG-CE1 4.09Å; E239-F491 HydrophobicContact CG-CE2 4.13Å; E239-F491 HydrophobicContact CG-CG 3.58Å; E239-F491 HydrophobicContact CG-CZ 4.26Å; P419-F491 HydrophobicContact CB-CE2 4.05Å; P419-F491 HydrophobicContact CB-CZ 3.59Å; P419-F491 HydrophobicContact CG-CE1 4.15Å; P419-F491 HydrophobicContact CG-CZ 3.63Å; Q489-F491 HydrophobicContact CB-CD1 4.49Å; Q489-F491 HydrophobicContact CB-CE1 4.23Å; Q489-F491 HydrophobicContact CG-CD1 4.38Å; Q489-F491 HydrophobicContact CG-CE1 4.38Å; Q489-F491 WeakPolarHBondContact O-CD1 3.41Å; Q489-F491 PolarHBondContact O-N 3.2Å; F491-V493 VanDerWaalsContact C-N 3.33Å; F491-V493 HydrophobicContact CB-CG2 4.23Å; F491-V493 PolarHBondContact O-N 2.94Å; F491-A494 HydrophobicContact CB-CB 3.9Å; F491-A494 PolarHBondContact O-N 3.3Å; F491-E495 PolarHBondContact O-N 2.85Å
492	H	88.1	Confident	88.7	Confident	50 Å²	50	39.6 Å²	39.6	23%	0.231	23%	0.229	C	C	.	.	S	Bend	trans	-64.2	-42.1	177.1	-62	87.3	0	0	0	111.3	E239 N242 N243 A494 E495 G502	E239-H492 IonicContact OE1-CE1 3.66Å; E239-H492 IonicContact OE1-CG 3.42Å; E239-H492 PolarHBondContact OE1-N 2.87Å; E239-H492 IonicContact OE1-ND1 3.78Å; E239-H492 PolarHBondContact OE1-ND1 2.95Å; E239-H492 PolarHBondContact OE2-N 3.23Å; E239-H492 IonicContact OE2-ND1 3.34Å; N242-H492 WeakPolarHBondContact ND2-CB 3.44Å; N243-H492 PolarHBondContact OD1-ND1 3.02Å; H492-A494 PolarHBondContact O-N 3.28Å; H492-E495 WeakPolarHBondContact O-CB 3.26Å; H492-E495 PolarHBondContact O-N 3.27Å; H492-G502 PolarHBondContact NE2-O 2.84Å
493	V	83.4	Confident	88.4	Confident	15 Å²	15	42.5 Å²	42.5	9%	0.091	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-21.3	179	-58.9	0	0	0	0	112.2	V235 M238 E239 N242 F491	V235-V493 HydrophobicContact CG1-CG2 4.22Å; M238-V493 HydrophobicContact CB-CB 4.22Å; M238-V493 HydrophobicContact CB-CG1 4Å; M238-V493 HydrophobicContact CB-CG2 4.08Å; E239-V493 HydrophobicContact CB-CG2 3.91Å; E239-V493 PolarHBondContact OE2-N 3.48Å; N242-V493 HydrophobicContact CB-CG1 4.13Å; F491-V493 VanDerWaalsContact C-N 3.33Å; F491-V493 HydrophobicContact CB-CG2 4.23Å; F491-V493 PolarHBondContact O-N 2.94Å
494	A	83.9	Confident	88.2	Confident	12 Å²	12	46.3 Å²	46.3	10%	0.099	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	3.6	179.8	0	0	0	0	0	113.8	V235 F491 H492 V496 F497 T498	V235-A494 HydrophobicContact CG1-CB 4.26Å; F491-A494 HydrophobicContact CB-CB 3.9Å; F491-A494 PolarHBondContact O-N 3.3Å; H492-A494 PolarHBondContact O-N 3.28Å; A494-V496 PolarHBondContact O-N 3.12Å; A494-F497 PolarHBondContact O-N 3.29Å; A494-T498 HydrophobicContact CB-CG2 4.14Å; A494-T498 WeakPolarHBondContact O-CB 3.34Å; A494-T498 WeakPolarHBondContact O-CG2 3.47Å; A494-T498 PolarHBondContact O-N 3.03Å; A494-T498 PolarHBondContact O-OG1 3.12Å
495	E	83.8	Confident	88.1	Confident	96 Å²	96	44.6 Å²	44.6	45%	0.449	25%	0.249	S	C	.	.	H	α-helix	trans	-57.2	-37.4	-179.9	-179.3	169.9	170.2	0	0	111.6	F491 H492 F497 G499	F491-E495 PolarHBondContact O-N 2.85Å; H492-E495 WeakPolarHBondContact O-CB 3.26Å; H492-E495 PolarHBondContact O-N 3.27Å; E495-F497 VanDerWaalsContact C-N 3.27Å; E495-F497 PolarHBondContact O-N 3.47Å; E495-G499 WeakPolarHBondContact O-CA 3.5Å; E495-G499 PolarHBondContact O-N 2.64Å
496	V	76.5	Confident	88	Confident	123 Å²	123	47.4 Å²	47.4	75%	0.745	27%	0.265	S	S	*	.	H	α-helix	trans	-61.7	-34.4	177.1	-175.8	0	0	0	0	112.3	A494	A494-V496 PolarHBondContact O-N 3.12Å
497	F	78.1	Confident	87.8	Confident	143 Å²	143	49.1 Å²	49.1	63%	0.627	27%	0.274	S	S	*	.	H	α-helix	trans	-91.6	-36.5	-177.2	-57.1	-72.2	0	0	0	112.8	A494 E495	A494-F497 PolarHBondContact O-N 3.29Å; E495-F497 VanDerWaalsContact C-N 3.27Å; E495-F497 PolarHBondContact O-N 3.47Å
498	T	80.9	Confident	87.7	Confident	65 Å²	65	56.6 Å²	56.6	40%	0.399	31%	0.306	S	S	.	.	H	α-helix	trans	-91.3	-23.4	-174.3	60.4	0	0	0	0	112.9	A494 A500 M532	A494-T498 HydrophobicContact CB-CG2 4.14Å; A494-T498 WeakPolarHBondContact O-CB 3.34Å; A494-T498 WeakPolarHBondContact O-CG2 3.47Å; A494-T498 PolarHBondContact O-N 3.03Å; A494-T498 PolarHBondContact O-OG1 3.12Å; T498-A500 PolarHBondContact O-N 3.28Å; T498-A500 PolarHBondContact OG1-N 2.97Å; T498-A500 PolarHBondContact OG1-O 3.28Å; T498-M532 HydrophobicContact CG2-CE 3.84Å
499	G	82.4	Confident	87.7	Confident	70 Å²	70	60 Å²	60	72%	0.722	32%	0.322	S	S	*	.			trans	67.8	6.9	-171.7	0	0	0	0	0	114	E495	E495-G499 WeakPolarHBondContact O-CA 3.5Å; E495-G499 PolarHBondContact O-N 2.64Å
500	A	84.3	Confident	87.6	Confident	29 Å²	29	60 Å²	60	24%	0.24	32%	0.322	C	S	.	.	S	Bend	trans	-107.7	135.5	178.3	0	0	0	0	0	109.8	P490 T498 G502	P490-A500 HydrophobicContact CB-CB 4.32Å; T498-A500 PolarHBondContact O-N 3.28Å; T498-A500 PolarHBondContact OG1-N 2.97Å; T498-A500 PolarHBondContact OG1-O 3.28Å; A500-G502 PolarHBondContact O-N 2.84Å
501	P	88	Confident	87.7	Confident	77 Å²	77	60.3 Å²	60.3	50%	0.5	32%	0.324	S	S	.	.			trans	-64.1	135.9	179	26.9	-34	0	0	0	110.4
502	G	88.8	Confident	87.8	Confident	10 Å²	10	65.2 Å²	65.2	10%	0.103	35%	0.351	C	S	.	.			trans	-59.3	149.4	176.5	0	0	0	0	0	113.1	P490 H492 A500	P490-G502 WeakPolarHBondContact O-CA 3.35Å; H492-G502 PolarHBondContact NE2-O 2.84Å; A500-G502 PolarHBondContact O-N 2.84Å
503	K	89.4	Confident	88.1	Confident	69 Å²	69	63 Å²	63	30%	0.3	34%	0.341	S	S	.	.			trans	-130	130.5	-179.4	-63.2	-71.7	177.3	151.9	0	110.6	Q489 P490 E538	Q489-K503 PolarHBondContact NE2-O 2.81Å; P490-K503 HydrophobicContact CG-CB 3.96Å; P490-K503 HydrophobicContact CG-CG 3.6Å; P490-K503 PolarHBondContact O-N 2.73Å; K503-E538 WeakPolarHBondContact CE-OE1 3.4Å; K503-E538 IonicContact NZ-OE1 2.91Å; K503-E538 PolarHBondContact NZ-OE1 3.1Å
504	Y	91.5	Very high	88.7	Confident	82 Å²	82	62.3 Å²	62.3	32%	0.322	34%	0.336	S	S	.	.			trans	-96.2	123.6	165.8	-176	-85	0	0	0	107.7	G207 N243 A247	G207-Y504 VanDerWaalsContact CA-CE2 3.49Å; N243-Y504 HydrophobicContact CB-CD2 4.04Å; N243-Y504 HydrophobicContact CB-CE2 4.11Å; A247-Y504 HydrophobicContact CB-CE2 4.11Å
505	V	92	Very high	89.2	Confident	4 Å²	4	64.6 Å²	64.6	2%	0.024	35%	0.345	C	S	.	.			trans	-107.5	127.8	-178.6	-176.7	0	0	0	0	109.3	G207 K209	G207-V505 WeakPolarHBondContact CA-O 3.5Å; G207-V505 PolarHBondContact O-N 2.83Å; K209-V505 HydrophobicContact CD-CB 4.46Å; K209-V505 HydrophobicContact CD-CG1 4.14Å; K209-V505 HydrophobicContact CD-CG2 4.17Å; K209-V505 HydrophobicContact CG-CB 3.87Å; K209-V505 HydrophobicContact CG-CG1 3.81Å; K209-V505 HydrophobicContact CG-CG2 3.97Å
506	E	93.1	Very high	89.7	Confident	124 Å²	124	60.1 Å²	60.1	58%	0.579	33%	0.325	S	S	*	.			trans	-71.4	143.3	176.9	-65.1	-169.8	174.1	0	0	111.4	K508 E509 S510	E506-K508 VanDerWaalsContact C-N 3.32Å; E506-K508 PolarHBondContact O-N 2.97Å; E506-E509 HydrophobicContact CB-CB 4.32Å; E506-E509 PolarHBondContact O-N 2.89Å; E506-S510 PolarHBondContact O-N 3.45Å
507	L	92.1	Very high	90.5	Very high	37 Å²	37	54.4 Å²	54.4	19%	0.194	29%	0.29	C	S	.	.	H	α-helix	trans	-55.2	-45.4	-178.8	173.8	62.5	0	0	0	112.5	V205 D212 E509 S510 V511	V205-L507 HydrophobicContact CG1-CB 4.32Å; V205-L507 HydrophobicContact CG2-CD2 4.42Å; D212-L507 HydrophobicContact CB-CD1 4.05Å; L507-E509 PolarHBondContact O-N 2.85Å; L507-S510 WeakPolarHBondContact O-CB 3.5Å; L507-S510 PolarHBondContact O-N 3.33Å; L507-V511 HydrophobicContact CD1-CG2 4.07Å; L507-V511 WeakPolarHBondContact O-CG2 3.25Å; L507-V511 PolarHBondContact O-N 3.24Å
508	K	93	Very high	91.3	Very high	166 Å²	166	48.9 Å²	48.9	72%	0.722	27%	0.267	S	S	*	.	H	α-helix	trans	-63.1	-42	-179.2	-68.2	-175.8	-179.9	179.1	0	112.1	E506 S510 N512	E506-K508 VanDerWaalsContact C-N 3.32Å; E506-K508 PolarHBondContact O-N 2.97Å; K508-S510 VanDerWaalsContact C-N 3.33Å; K508-N512 WeakPolarHBondContact O-CB 3.35Å; K508-N512 VanDerWaalsContact O-CG 3.26Å; K508-N512 PolarHBondContact O-N 3.38Å; K508-N512 PolarHBondContact O-ND2 3.4Å
509	E	92.9	Very high	91.9	Very high	71 Å²	71	49.7 Å²	49.7	33%	0.332	27%	0.269	S	S	.	.	H	α-helix	trans	-63.8	-42.1	176.2	-172.6	-172.3	172	0	0	110.8	E506 L507 S513 G535	E506-E509 HydrophobicContact CB-CB 4.32Å; E506-E509 PolarHBondContact O-N 2.89Å; L507-E509 PolarHBondContact O-N 2.85Å; E509-S513 VanDerWaalsContact O-CB 3.24Å; E509-S513 WeakPolarHBondContact O-CB 3.48Å; E509-S513 PolarHBondContact O-N 3.17Å; E509-S513 PolarHBondContact O-OG 2.83Å; E509-G535 WeakPolarHBondContact OE1-CA 3.24Å
510	S	93	Very high	92.3	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.014	24%	0.243	C	C	.	.	H	α-helix	trans	-58.8	-54.5	176	-166	0	0	0	0	111.4	E506 L507 K508 N512 S513 F514	E506-S510 PolarHBondContact O-N 3.45Å; L507-S510 WeakPolarHBondContact O-CB 3.5Å; L507-S510 PolarHBondContact O-N 3.33Å; K508-S510 VanDerWaalsContact C-N 3.33Å; S510-N512 PolarHBondContact O-N 3.06Å; S510-S513 PolarHBondContact O-N 3.35Å; S510-S513 VanDerWaalsContact O-N 3.15Å; S510-F514 VanDerWaalsContact O-CD2 3.22Å; S510-F514 WeakPolarHBondContact O-CD2 3.38Å; S510-F514 PolarHBondContact O-N 3.08Å
511	V	94.9	Very high	92.7	Very high	12 Å²	12	52.1 Å²	52.1	7%	0.073	26%	0.259	C	S	.	.	H	α-helix	trans	-57.1	-48.8	-179.9	173.6	0	0	0	0	111.1	L213 H440 L507 S513 F514 Q515	L213-V511 HydrophobicContact CD1-CG2 4.09Å; H440-V511 HydrophobicContact CB-CG1 4.49Å; H440-V511 HydrophobicContact CB-CG2 3.99Å; L507-V511 HydrophobicContact CD1-CG2 4.07Å; L507-V511 WeakPolarHBondContact O-CG2 3.25Å; L507-V511 PolarHBondContact O-N 3.24Å; V511-S513 VanDerWaalsContact C-N 3.33Å; V511-S513 PolarHBondContact O-N 2.94Å; V511-F514 PolarHBondContact O-N 3.37Å; V511-Q515 WeakPolarHBondContact O-CB 3.2Å; V511-Q515 PolarHBondContact O-N 3.46Å
512	N	94.6	Very high	92.9	Very high	113 Å²	113	50.7 Å²	50.7	60%	0.604	24%	0.244	S	C	*	.	H	α-helix	trans	-62	-40.1	178.7	-71.7	-22.1	0	0	0	112.6	K508 S510 Q515 G516	K508-N512 WeakPolarHBondContact O-CB 3.35Å; K508-N512 VanDerWaalsContact O-CG 3.26Å; K508-N512 PolarHBondContact O-N 3.38Å; K508-N512 PolarHBondContact O-ND2 3.4Å; S510-N512 PolarHBondContact O-N 3.06Å; N512-Q515 PolarHBondContact O-N 3.37Å; N512-G516 PolarHBondContact O-N 2.82Å
513	S	94.3	Very high	93	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.014	25%	0.251	C	S	.	.	H	α-helix	trans	-64.7	-48.1	179.1	-61.4	0	0	0	0	111.2	E509 S510 V511 G516 V517	E509-S513 VanDerWaalsContact O-CB 3.24Å; E509-S513 WeakPolarHBondContact O-CB 3.48Å; E509-S513 PolarHBondContact O-N 3.17Å; E509-S513 PolarHBondContact O-OG 2.83Å; S510-S513 PolarHBondContact O-N 3.35Å; S510-S513 VanDerWaalsContact O-N 3.15Å; V511-S513 VanDerWaalsContact C-N 3.33Å; V511-S513 PolarHBondContact O-N 2.94Å; S513-G516 PolarHBondContact O-N 2.81Å; S513-V517 WeakPolarHBondContact O-CG2 3.28Å; S513-V517 PolarHBondContact O-N 3.4Å; S513-V517 VanDerWaalsContact O-N 3.14Å
514	F	95.4	Very high	93	Very high	1 Å²	1	56.6 Å²	56.6	0%	0.004	28%	0.277	C	S	.	.	H	α-helix	trans	-66.7	-39.1	177.4	-80	-78.3	0	0	0	112	K209 L213 T443 V447 I483 F486 L487 S510 V511 G516 V517 L518	K209-F514 HydrophobicContact CB-CE2 4.31Å; K209-F514 HydrophobicContact CD-CE2 4.26Å; L213-F514 HydrophobicContact CD2-CB 4.16Å; L213-F514 HydrophobicContact CD2-CD1 4.01Å; L213-F514 HydrophobicContact CD2-CD2 3.49Å; L213-F514 VanDerWaalsContact CD2-CD2 3.49Å; L213-F514 HydrophobicContact CD2-CE1 4.28Å; L213-F514 HydrophobicContact CD2-CE2 3.82Å; L213-F514 HydrophobicContact CD2-CG 3.61Å; L213-F514 HydrophobicContact CD2-CZ 4.21Å; T443-F514 HydrophobicContact CG2-CB 3.54Å; V447-F514 HydrophobicContact CG2-CB 4.14Å; V447-F514 HydrophobicContact CG2-CD1 3.81Å; V447-F514 HydrophobicContact CG2-CG 4.26Å; I483-F514 HydrophobicContact CG2-CE1 4.25Å; F486-F514 HydrophobicContact CB-CE1 4.35Å; F486-F514 HydrophobicContact CB-CZ 4.48Å; F486-F514 AromaticContact CD1-CD1 3.87Å; F486-F514 HydrophobicContact CD1-CD1 3.87Å; F486-F514 HydrophobicContact CD1-CD2 4.28Å; F486-F514 AromaticContact CD1-CE1 3.45Å; F486-F514 HydrophobicContact CD1-CE1 3.45Å; F486-F514 VanDerWaalsContact CD1-CE1 3.45Å; F486-F514 AromaticContact CD1-CE2 3.88Å; F486-F514 HydrophobicContact CD1-CE2 3.88Å; F486-F514 HydrophobicContact CD1-CG 4.26Å; F486-F514 AromaticContact CD1-CZ 3.43Å; F486-F514 HydrophobicContact CD1-CZ 3.43Å; F486-F514 VanDerWaalsContact CD1-CZ 3.43Å; F486-F514 HydrophobicContact CE1-CD1 4.32Å; F486-F514 HydrophobicContact CE1-CD2 4.03Å; F486-F514 HydrophobicContact CE1-CE1 4.17Å; F486-F514 AromaticContact CE1-CE2 3.85Å; F486-F514 HydrophobicContact CE1-CE2 3.85Å; F486-F514 HydrophobicContact CE1-CG 4.25Å; F486-F514 AromaticContact CE1-CZ 3.91Å; F486-F514 HydrophobicContact CE1-CZ 3.91Å; F486-F514 HydrophobicContact CG-CE1 4.31Å; F486-F514 HydrophobicContact CG-CZ 4.21Å; L487-F514 HydrophobicContact CD2-CE1 3.88Å; L487-F514 HydrophobicContact CD2-CE2 4.43Å; L487-F514 HydrophobicContact CD2-CZ 3.53Å; L487-F514 HydrophobicContact CG-CE1 4.15Å; L487-F514 HydrophobicContact CG-CZ 4.07Å; S510-F514 VanDerWaalsContact O-CD2 3.22Å; S510-F514 WeakPolarHBondContact O-CD2 3.38Å; S510-F514 PolarHBondContact O-N 3.08Å; V511-F514 PolarHBondContact O-N 3.37Å; F514-G516 VanDerWaalsContact C-N 3.31Å; F514-G516 PolarHBondContact O-N 3.28Å; F514-V517 PolarHBondContact O-N 2.75Å; F514-V517 VanDerWaalsContact O-N 3.16Å; F514-L518 WeakPolarHBondContact O-CG 3.46Å; F514-L518 PolarHBondContact O-N 3.38Å
515	Q	95	Very high	93.1	Very high	61 Å²	61	54.4 Å²	54.4	29%	0.285	27%	0.271	S	S	.	.	H	α-helix	trans	-60.1	-43.3	174.7	-171.9	58.3	46.5	0	0	111.1	T443 V511 N512 V517 L518 D519	T443-Q515 HydrophobicContact CG2-CB 4.24Å; T443-Q515 PolarHBondContact OG1-OE1 3.3Å; V511-Q515 WeakPolarHBondContact O-CB 3.2Å; V511-Q515 PolarHBondContact O-N 3.46Å; N512-Q515 PolarHBondContact O-N 3.37Å; Q515-V517 VanDerWaalsContact C-N 3.3Å; Q515-V517 PolarHBondContact O-N 2.85Å; Q515-L518 WeakPolarHBondContact O-CB 3.38Å; Q515-L518 PolarHBondContact O-N 2.84Å; Q515-L518 VanDerWaalsContact O-N 3.14Å; Q515-D519 PolarHBondContact NE2-OD1 3.02Å; Q515-D519 WeakPolarHBondContact O-CB 3.48Å; Q515-D519 PolarHBondContact O-N 2.92Å
516	G	93.9	Very high	93.1	Very high	2 Å²	2	56.7 Å²	56.7	2%	0.021	29%	0.285	C	S	.	.	H	α-helix	trans	-64.1	-32.3	176.3	0	0	0	0	0	114	N512 S513 F514 G520 K521	N512-G516 PolarHBondContact O-N 2.82Å; S513-G516 PolarHBondContact O-N 2.81Å; F514-G516 VanDerWaalsContact C-N 3.31Å; F514-G516 PolarHBondContact O-N 3.28Å; G516-G520 PolarHBondContact O-N 2.96Å; G516-K521 WeakPolarHBondContact O-CB 2.99Å; G516-K521 PolarHBondContact O-N 2.65Å
517	V	93.5	Very high	93	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.012	27%	0.269	C	S	.	.	H	α-helix	trans	-68.5	-40.9	171.8	176.8	0	0	0	0	111.1	I483 S513 F514 Q515 D519 G520 Y522 F530 I536	I483-V517 HydrophobicContact CD1-CG1 4.3Å; I483-V517 HydrophobicContact CG1-CG1 3.76Å; S513-V517 WeakPolarHBondContact O-CG2 3.28Å; S513-V517 PolarHBondContact O-N 3.4Å; S513-V517 VanDerWaalsContact O-N 3.14Å; F514-V517 PolarHBondContact O-N 2.75Å; F514-V517 VanDerWaalsContact O-N 3.16Å; Q515-V517 VanDerWaalsContact C-N 3.3Å; Q515-V517 PolarHBondContact O-N 2.85Å; V517-D519 VanDerWaalsContact C-N 3.34Å; V517-G520 PolarHBondContact O-N 2.85Å; V517-Y522 HydrophobicContact CG2-CD2 3.83Å; V517-F530 HydrophobicContact CG2-CE1 3.79Å; V517-F530 HydrophobicContact CG2-CZ 4.47Å; V517-I536 HydrophobicContact CG2-CD1 4.43Å
518	L	93.9	Very high	93	Very high	28 Å²	28	57.8 Å²	57.8	15%	0.147	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-38.6	175.9	-67.8	175.7	0	0	0	112.4	T443 V447 V450 R479 I483 F514 Q515 G520	T443-L518 HydrophobicContact CG2-CD1 4.19Å; V447-L518 HydrophobicContact CG2-CD1 4.16Å; V447-L518 HydrophobicContact CG2-CD2 4.29Å; V447-L518 HydrophobicContact CG2-CG 4.35Å; V450-L518 HydrophobicContact CG2-CD2 3.8Å; R479-L518 PolarHBondContact NH1-O 2.8Å; I483-L518 HydrophobicContact CD1-CD2 4.14Å; F514-L518 WeakPolarHBondContact O-CG 3.46Å; F514-L518 PolarHBondContact O-N 3.38Å; Q515-L518 WeakPolarHBondContact O-CB 3.38Å; Q515-L518 PolarHBondContact O-N 2.84Å; Q515-L518 VanDerWaalsContact O-N 3.14Å; L518-G520 PolarHBondContact O-N 3.19Å
519	D	93.7	Very high	92.9	Very high	82 Å²	82	49.9 Å²	49.9	44%	0.439	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-10.8	176.4	-64.4	-14.2	0	0	0	112.9	Q515 V517 K521	Q515-D519 PolarHBondContact NE2-OD1 3.02Å; Q515-D519 WeakPolarHBondContact O-CB 3.48Å; Q515-D519 PolarHBondContact O-N 2.92Å; V517-D519 VanDerWaalsContact C-N 3.34Å; D519-K521 HydrophobicContact CB-CD 4.36Å; D519-K521 HydrophobicContact CB-CG 4.13Å; D519-K521 IonicContact OD2-NZ 2.79Å; D519-K521 PolarHBondContact OD2-NZ 2.87Å
520	G	91.3	Very high	93	Very high	18 Å²	18	46.5 Å²	46.5	19%	0.186	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	11.6	-178.5	0	0	0	0	0	115	G516 V517 L518 Y522 D523	G516-G520 PolarHBondContact O-N 2.96Å; V517-G520 PolarHBondContact O-N 2.85Å; L518-G520 PolarHBondContact O-N 3.19Å; G520-Y522 PolarHBondContact O-N 3.49Å; G520-Y522 VanDerWaalsContact O-N 3.11Å; G520-D523 WeakPolarHBondContact CA-OD2 3.04Å; G520-D523 PolarHBondContact O-N 2.92Å
521	K	91.9	Very high	93	Very high	131 Å²	131	50.5 Å²	50.5	57%	0.57	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-19	-177.9	-66.5	173.5	179.9	142.4	0	113.8	G516 D519	G516-K521 WeakPolarHBondContact O-CB 2.99Å; G516-K521 PolarHBondContact O-N 2.65Å; D519-K521 HydrophobicContact CB-CD 4.36Å; D519-K521 HydrophobicContact CB-CG 4.13Å; D519-K521 IonicContact OD2-NZ 2.79Å; D519-K521 PolarHBondContact OD2-NZ 2.87Å
522	Y	92.1	Very high	92.8	Very high	47 Å²	47	51.5 Å²	51.5	18%	0.184	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	22.7	-174.2	-49.2	-63.8	0	0	0	112.4	K482 V517 G520 D524 L525 I536 I540	K482-Y522 PolarHBondContact NZ-O 2.87Å; V517-Y522 HydrophobicContact CG2-CD2 3.83Å; G520-Y522 PolarHBondContact O-N 3.49Å; G520-Y522 VanDerWaalsContact O-N 3.11Å; Y522-D524 VanDerWaalsContact C-N 3.26Å; Y522-D524 PolarHBondContact O-N 3.22Å; Y522-L525 HydrophobicContact CD1-CD1 4.02Å; Y522-L525 HydrophobicContact CG-CD1 4.39Å; Y522-L525 PolarHBondContact O-N 3.2Å; Y522-I536 HydrophobicContact CD1-CD1 4.22Å; Y522-I536 HydrophobicContact CD1-CG1 4.19Å; Y522-I536 HydrophobicContact CD2-CD1 3.6Å; Y522-I536 HydrophobicContact CD2-CG1 3.96Å; Y522-I536 HydrophobicContact CE1-CD1 4.25Å; Y522-I536 HydrophobicContact CE1-CG1 3.73Å; Y522-I536 HydrophobicContact CE2-CD1 3.61Å; Y522-I536 HydrophobicContact CE2-CG1 3.45Å; Y522-I536 VanDerWaalsContact CE2-CG1 3.45Å; Y522-I536 HydrophobicContact CG-CD1 3.91Å; Y522-I536 HydrophobicContact CG-CG1 4.3Å; Y522-I540 HydrophobicContact CE1-CD1 4.15Å
523	D	91	Very high	92.6	Very high	45 Å²	45	46.3 Å²	46.3	24%	0.241	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-27.5	-180	-78	-13.1	0	0	0	112.7	R479 K482 G520 L525	R479-D523 WeakPolarHBondContact CG-OD1 3.22Å; R479-D523 IonicContact CZ-OD2 3.43Å; R479-D523 IonicContact NE-OD1 2.76Å; R479-D523 PolarHBondContact NE-OD1 3.31Å; R479-D523 VanDerWaalsContact NE-OD1 3.16Å; R479-D523 IonicContact NE-OD2 3.76Å; R479-D523 PolarHBondContact NE-OD2 2.93Å; R479-D523 IonicContact NH2-OD2 2.69Å; R479-D523 PolarHBondContact NH2-OD2 3.46Å; K482-D523 VanDerWaalsContact NZ-CA 3.26Å; K482-D523 PolarHBondContact NZ-O 2.79Å; G520-D523 WeakPolarHBondContact CA-OD2 3.04Å; G520-D523 PolarHBondContact O-N 2.92Å; D523-L525 VanDerWaalsContact C-N 3.29Å; D523-L525 PolarHBondContact O-N 2.84Å
524	D	90.8	Very high	92.3	Very high	159 Å²	159	46.4 Å²	46.4	85%	0.85	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-16	177.2	-58.2	-42.8	0	0	0	113.4	Y522	Y522-D524 VanDerWaalsContact C-N 3.26Å; Y522-D524 PolarHBondContact O-N 3.22Å
525	L	92.3	Very high	92.1	Very high	36 Å²	36	46.6 Å²	46.6	19%	0.188	24%	0.235	C	C	.	.	S	Bend	trans	-78.7	142	-177.3	-56.3	-172.6	0	0	0	111.6	K482 Y522 D523 F530 V539 I540 A543	K482-L525 WeakPolarHBondContact CE-O 3.37Å; K482-L525 PolarHBondContact NZ-O 3.19Å; Y522-L525 HydrophobicContact CD1-CD1 4.02Å; Y522-L525 HydrophobicContact CG-CD1 4.39Å; Y522-L525 PolarHBondContact O-N 3.2Å; D523-L525 VanDerWaalsContact C-N 3.29Å; D523-L525 PolarHBondContact O-N 2.84Å; L525-F530 HydrophobicContact CB-CE2 4.01Å; L525-F530 HydrophobicContact CB-CZ 4.46Å; L525-V539 HydrophobicContact CD1-CG1 3.84Å; L525-I540 HydrophobicContact CD1-CG1 4.03Å; L525-A543 HydrophobicContact CB-CB 4.38Å; L525-A543 HydrophobicContact CD2-CB 3.82Å; L525-A543 HydrophobicContact CG-CB 4.46Å
526	P	92.6	Very high	91.8	Very high	52 Å²	52	44.6 Å²	44.6	34%	0.338	23%	0.226	S	C	.	.			trans	-68	144	-179.5	27.4	-34.1	0	0	0	111.9	Q528 S529 A543 I546	P526-Q528 PolarHBondContact O-N 2.66Å; P526-Q528 VanDerWaalsContact O-N 3.09Å; P526-S529 WeakPolarHBondContact O-CB 3.37Å; P526-S529 PolarHBondContact O-N 3.33Å; P526-S529 PolarHBondContact O-OG 3.36Å; P526-A543 HydrophobicContact CG-CB 4.19Å; P526-I546 HydrophobicContact CG-CD1 4.37Å
527	E	91.1	Very high	91.7	Very high	49 Å²	49	51.8 Å²	51.8	23%	0.229	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-54.2	-35	-177.9	-61.4	-176.5	-173.5	0	0	113.6	R481 K482 R485 S529 F530	R481-E527 IonicContact CZ-OE1 3.84Å; R481-E527 IonicContact CZ-OE2 2.88Å; R481-E527 IonicContact NE-OE1 2.71Å; R481-E527 IonicContact NE-OE2 3.7Å; R481-E527 IonicContact NH1-OE1 3.62Å; R481-E527 PolarHBondContact NH1-OE1 2.84Å; R481-E527 IonicContact NH1-OE2 3.39Å; R481-E527 PolarHBondContact NH1-OE2 2.91Å; K482-E527 HydrophobicContact CG-CG 4.2Å; R485-E527 WeakPolarHBondContact CD-O 3.48Å; R485-E527 IonicContact CZ-OE2 2.7Å; R485-E527 IonicContact NH1-OE2 2.8Å; R485-E527 PolarHBondContact NH1-OE2 3.46Å; R485-E527 IonicContact NH2-OE2 3.9Å; R485-E527 PolarHBondContact NH2-OE2 3.12Å; E527-S529 PolarHBondContact O-N 2.93Å; E527-F530 PolarHBondContact O-N 2.85Å
528	Q	91.4	Very high	91.6	Very high	134 Å²	134	54.7 Å²	54.7	63%	0.626	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-67.9	-22.1	-178.7	-67.6	-177.6	-7.4	0	0	113.6	P526 F530 Y531 I546	P526-Q528 PolarHBondContact O-N 2.66Å; P526-Q528 VanDerWaalsContact O-N 3.09Å; Q528-F530 PolarHBondContact O-N 2.69Å; Q528-Y531 PolarHBondContact O-N 2.75Å; Q528-I546 HydrophobicContact CB-CD1 4.25Å
529	S	92	Very high	91.5	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-67.2	-22.7	176.8	65.3	0	0	0	0	112.6	P526 E527 V533 V539	P526-S529 WeakPolarHBondContact O-CB 3.37Å; P526-S529 PolarHBondContact O-N 3.33Å; P526-S529 PolarHBondContact O-OG 3.36Å; E527-S529 PolarHBondContact O-N 2.93Å; S529-V533 WeakPolarHBondContact O-CG1 3.46Å; S529-V539 WeakPolarHBondContact CB-O 3.46Å; S529-V539 WeakPolarHBondContact OG-CG1 3.39Å
530	F	94.3	Very high	91.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-84.4	-8.2	179.3	-68.6	-92.7	0	0	0	114.2	K482 R485 F486 V517 L525 E527 Q528 V533 I536 V539	K482-F530 HydrophobicContact CB-CD1 4.45Å; K482-F530 HydrophobicContact CB-CD2 4.01Å; K482-F530 HydrophobicContact CB-CE2 4.11Å; K482-F530 HydrophobicContact CB-CG 4.18Å; K482-F530 HydrophobicContact CB-CZ 4.35Å; K482-F530 HydrophobicContact CD-CD2 4.25Å; K482-F530 HydrophobicContact CD-CE2 3.68Å; K482-F530 HydrophobicContact CD-CZ 4.08Å; K482-F530 HydrophobicContact CG-CD2 3.82Å; K482-F530 HydrophobicContact CG-CE2 3.79Å; K482-F530 HydrophobicContact CG-CG 4.47Å; K482-F530 HydrophobicContact CG-CZ 4.4Å; R485-F530 CarbonylContact C-O 3.56Å; R485-F530 VanDerWaalsContact C-O 3.22Å; R485-F530 HydrophobicContact CB-CB 4.11Å; F486-F530 VanDerWaalsContact CA-O 3.31Å; F486-F530 WeakPolarHBondContact CA-O 3.17Å; F486-F530 HydrophobicContact CB-CB 4.09Å; F486-F530 HydrophobicContact CB-CD1 3.78Å; F486-F530 HydrophobicContact CB-CG 4.39Å; F486-F530 AromaticContact CD2-CD1 3.84Å; F486-F530 HydrophobicContact CD2-CD1 3.84Å; F486-F530 AromaticContact CG-CD1 3.82Å; F486-F530 HydrophobicContact CG-CD1 3.82Å; F486-F530 PolarHBondContact N-O 2.98Å; V517-F530 HydrophobicContact CG2-CE1 3.79Å; V517-F530 HydrophobicContact CG2-CZ 4.47Å; L525-F530 HydrophobicContact CB-CE2 4.01Å; L525-F530 HydrophobicContact CB-CZ 4.46Å; E527-F530 PolarHBondContact O-N 2.85Å; Q528-F530 PolarHBondContact O-N 2.69Å; F530-V533 WeakPolarHBondContact O-CG2 3.48Å; F530-I536 HydrophobicContact CE1-CD1 4.13Å; F530-V539 HydrophobicContact CD1-CG1 3.84Å; F530-V539 HydrophobicContact CD1-CG2 3.96Å; F530-V539 HydrophobicContact CD2-CG1 3.92Å; F530-V539 HydrophobicContact CE1-CG1 3.75Å; F530-V539 HydrophobicContact CE1-CG2 4.31Å; F530-V539 HydrophobicContact CE2-CG1 3.8Å; F530-V539 HydrophobicContact CG-CG1 3.95Å; F530-V539 HydrophobicContact CG-CG2 4.44Å; F530-V539 HydrophobicContact CZ-CG1 3.73Å
531	Y	93.3	Very high	91.4	Very high	87 Å²	87	54.2 Å²	54.2	34%	0.341	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	132.2	-176	179.4	-108.1	0	0	0	112.6	G416 Q528 K542	G416-Y531 WeakPolarHBondContact O-CE2 3.44Å; G416-Y531 PolarHBondContact O-OH 2.94Å; Q528-Y531 PolarHBondContact O-N 2.75Å; Y531-K542 PolarHBondContact O-NZ 3.3Å
532	M	90.7	Very high	91.4	Very high	32 Å²	32	51.2 Å²	51.2	16%	0.158	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	54.5	176.9	-68.1	-71.5	-82.3	0	0	112.9	S488 P490 T498	S488-M532 PolarHBondContact OG-N 3.23Å; P490-M532 HydrophobicContact CB-CE 4.02Å; T498-M532 HydrophobicContact CG2-CE 3.84Å
533	V	91	Very high	91.3	Very high	5 Å²	5	49.4 Å²	49.4	3%	0.03	25%	0.254	C	S	.	.			trans	-129.7	153.6	178.7	-65.7	0	0	0	0	109.9	K209 F486 S529 F530 E538 V539 K542	K209-V533 PolarHBondContact NZ-O 3.34Å; F486-V533 HydrophobicContact CD2-CG2 3.92Å; F486-V533 HydrophobicContact CE2-CG2 4Å; S529-V533 WeakPolarHBondContact O-CG1 3.46Å; F530-V533 WeakPolarHBondContact O-CG2 3.48Å; V533-E538 HydrophobicContact CB-CB 4.1Å; V533-E538 HydrophobicContact CG1-CB 4.29Å; V533-V539 HydrophobicContact CG2-CG2 3.67Å; V533-K542 HydrophobicContact CG1-CD 3.94Å
534	G	88.2	Confident	91.3	Very high	3 Å²	3	52.3 Å²	52.3	3%	0.031	27%	0.267	C	S	.	.	S	Bend	trans	-77.2	-86.6	173.9	0	0	0	0	0	111.2	K209 E538	K209-G534 WeakPolarHBondContact CD-O 3.41Å; K209-G534 WeakPolarHBondContact CE-O 3.5Å; K209-G534 PolarHBondContact NZ-O 3.17Å; G534-E538 PolarHBondContact N-OE2 2.77Å
535	G	89.4	Confident	91.3	Very high	5 Å²	5	50.7 Å²	50.7	5%	0.052	25%	0.252	C	S	.	.	S	Bend	trans	-94.7	177.1	-177.2	0	0	0	0	0	115.3	E509 E537 E538 V539	E509-G535 WeakPolarHBondContact OE1-CA 3.24Å; G535-E537 VanDerWaalsContact C-N 3.31Å; G535-E537 PolarHBondContact O-N 3.35Å; G535-E538 PolarHBondContact O-N 2.89Å; G535-V539 PolarHBondContact O-N 3.39Å
536	I	90.2	Very high	91	Very high	19 Å²	19	50.6 Å²	50.6	10%	0.097	25%	0.251	C	S	.	.	H	α-helix	trans	-69.3	-28.3	177.9	-161	62.2	0	0	0	113.3	V517 Y522 F530 E538 V539 I540	V517-I536 HydrophobicContact CG2-CD1 4.43Å; Y522-I536 HydrophobicContact CD1-CD1 4.22Å; Y522-I536 HydrophobicContact CD1-CG1 4.19Å; Y522-I536 HydrophobicContact CD2-CD1 3.6Å; Y522-I536 HydrophobicContact CD2-CG1 3.96Å; Y522-I536 HydrophobicContact CE1-CD1 4.25Å; Y522-I536 HydrophobicContact CE1-CG1 3.73Å; Y522-I536 HydrophobicContact CE2-CD1 3.61Å; Y522-I536 HydrophobicContact CE2-CG1 3.45Å; Y522-I536 VanDerWaalsContact CE2-CG1 3.45Å; Y522-I536 HydrophobicContact CG-CD1 3.91Å; Y522-I536 HydrophobicContact CG-CG1 4.3Å; F530-I536 HydrophobicContact CE1-CD1 4.13Å; I536-E538 VanDerWaalsContact C-N 3.26Å; I536-E538 PolarHBondContact O-N 3.04Å; I536-V539 HydrophobicContact CD1-CB 4.06Å; I536-V539 HydrophobicContact CD1-CG1 4.38Å; I536-V539 HydrophobicContact CD1-CG2 4.04Å; I536-V539 VanDerWaalsContact O-CB 3.3Å; I536-V539 WeakPolarHBondContact O-CB 3.36Å; I536-V539 PolarHBondContact O-N 3.26Å; I536-V539 VanDerWaalsContact O-N 3.11Å; I536-I540 WeakPolarHBondContact O-CG1 3.33Å; I536-I540 PolarHBondContact O-N 3.08Å
537	E	91	Very high	90.8	Very high	154 Å²	154	50.9 Å²	50.9	72%	0.72	26%	0.258	S	S	*	.	H	α-helix	trans	-61.7	-38.1	175.9	-62.4	-175.2	173.7	0	0	111.2	G535 V539 I540 A541	G535-E537 VanDerWaalsContact C-N 3.31Å; G535-E537 PolarHBondContact O-N 3.35Å; E537-V539 VanDerWaalsContact C-N 3.34Å; E537-I540 PolarHBondContact O-N 3.4Å; E537-A541 WeakPolarHBondContact O-CB 2.91Å; E537-A541 PolarHBondContact O-N 2.76Å
538	E	90.9	Very high	90.6	Very high	63 Å²	63	55.4 Å²	55.4	29%	0.294	28%	0.277	S	S	.	.	H	α-helix	trans	-68.7	-33.7	175.1	-65.3	-171.4	172.3	0	0	112	K503 V533 G534 G535 I536 K542	K503-E538 WeakPolarHBondContact CE-OE1 3.4Å; K503-E538 IonicContact NZ-OE1 2.91Å; K503-E538 PolarHBondContact NZ-OE1 3.1Å; V533-E538 HydrophobicContact CB-CB 4.1Å; V533-E538 HydrophobicContact CG1-CB 4.29Å; G534-E538 PolarHBondContact N-OE2 2.77Å; G535-E538 PolarHBondContact O-N 2.89Å; I536-E538 VanDerWaalsContact C-N 3.26Å; I536-E538 PolarHBondContact O-N 3.04Å; E538-K542 WeakPolarHBondContact O-CB 3.29Å; E538-K542 PolarHBondContact O-N 2.85Å
539	V	91.5	Very high	90.3	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.2	-48.7	173.2	-179.8	0	0	0	0	109.8	F486 L525 S529 F530 V533 G535 I536 E537 K542 A543	F486-V539 HydrophobicContact CD2-CG2 3.99Å; F486-V539 HydrophobicContact CE2-CG2 3.72Å; L525-V539 HydrophobicContact CD1-CG1 3.84Å; S529-V539 WeakPolarHBondContact CB-O 3.46Å; S529-V539 WeakPolarHBondContact OG-CG1 3.39Å; F530-V539 HydrophobicContact CD1-CG1 3.84Å; F530-V539 HydrophobicContact CD1-CG2 3.96Å; F530-V539 HydrophobicContact CD2-CG1 3.92Å; F530-V539 HydrophobicContact CE1-CG1 3.75Å; F530-V539 HydrophobicContact CE1-CG2 4.31Å; F530-V539 HydrophobicContact CE2-CG1 3.8Å; F530-V539 HydrophobicContact CG-CG1 3.95Å; F530-V539 HydrophobicContact CG-CG2 4.44Å; F530-V539 HydrophobicContact CZ-CG1 3.73Å; V533-V539 HydrophobicContact CG2-CG2 3.67Å; G535-V539 PolarHBondContact O-N 3.39Å; I536-V539 HydrophobicContact CD1-CB 4.06Å; I536-V539 HydrophobicContact CD1-CG1 4.38Å; I536-V539 HydrophobicContact CD1-CG2 4.04Å; I536-V539 VanDerWaalsContact O-CB 3.3Å; I536-V539 WeakPolarHBondContact O-CB 3.36Å; I536-V539 PolarHBondContact O-N 3.26Å; I536-V539 VanDerWaalsContact O-N 3.11Å; E537-V539 VanDerWaalsContact C-N 3.34Å; V539-K542 PolarHBondContact O-N 3.03Å; V539-A543 WeakPolarHBondContact O-CB 3.35Å; V539-A543 PolarHBondContact O-N 3.34Å
540	I	92	Very high	89.7	Confident	61 Å²	61	58.8 Å²	58.8	31%	0.313	30%	0.304	S	S	.	.	H	α-helix	trans	-61.7	-49.6	179.6	-63.6	165.8	0	0	0	110.1	Y522 L525 I536 E537 K542 A543 E544	Y522-I540 HydrophobicContact CE1-CD1 4.15Å; L525-I540 HydrophobicContact CD1-CG1 4.03Å; I536-I540 WeakPolarHBondContact O-CG1 3.33Å; I536-I540 PolarHBondContact O-N 3.08Å; E537-I540 PolarHBondContact O-N 3.4Å; I540-K542 VanDerWaalsContact C-N 3.3Å; I540-K542 PolarHBondContact O-N 3.45Å; I540-A543 WeakPolarHBondContact O-CB 3.47Å; I540-A543 PolarHBondContact O-N 2.9Å; I540-A543 VanDerWaalsContact O-N 3.17Å; I540-E544 WeakPolarHBondContact O-CG 3.04Å; I540-E544 PolarHBondContact O-N 3.42Å
541	A	91.7	Very high	88.9	Confident	57 Å²	57	63.1 Å²	63.1	47%	0.471	34%	0.339	S	S	.	.	H	α-helix	trans	-60.3	-39	178.8	0	0	0	0	0	112.6	E537 K545	E537-A541 WeakPolarHBondContact O-CB 2.91Å; E537-A541 PolarHBondContact O-N 2.76Å; A541-K545 PolarHBondContact O-N 2.82Å; A541-K545 VanDerWaalsContact O-N 3.12Å
542	K	91.3	Very high	87.6	Confident	68 Å²	68	66 Å²	66	30%	0.296	37%	0.372	S	S	.	.	H	α-helix	trans	-70.4	-38.1	176.9	-171.3	169	177.2	175.5	0	111.8	Y531 V533 E538 V539 I540 K545 I546	Y531-K542 PolarHBondContact O-NZ 3.3Å; V533-K542 HydrophobicContact CG1-CD 3.94Å; E538-K542 WeakPolarHBondContact O-CB 3.29Å; E538-K542 PolarHBondContact O-N 2.85Å; V539-K542 PolarHBondContact O-N 3.03Å; I540-K542 VanDerWaalsContact C-N 3.3Å; I540-K542 PolarHBondContact O-N 3.45Å; K542-K545 PolarHBondContact O-N 2.82Å; K542-I546 HydrophobicContact CG-CD1 4.21Å; K542-I546 VanDerWaalsContact O-CG1 3.3Å; K542-I546 WeakPolarHBondContact O-CG1 3.43Å; K542-I546 PolarHBondContact O-N 3.28Å
543	A	90.1	Very high	87.4	Confident	8 Å²	8	67.7 Å²	67.7	7%	0.066	38%	0.383	C	S	.	.	H	α-helix	trans	-62.8	-43.8	174.1	0	0	0	0	0	111.8	L525 P526 V539 I540 K545 I546 A547	L525-A543 HydrophobicContact CB-CB 4.38Å; L525-A543 HydrophobicContact CD2-CB 3.82Å; L525-A543 HydrophobicContact CG-CB 4.46Å; P526-A543 HydrophobicContact CG-CB 4.19Å; V539-A543 WeakPolarHBondContact O-CB 3.35Å; V539-A543 PolarHBondContact O-N 3.34Å; I540-A543 WeakPolarHBondContact O-CB 3.47Å; I540-A543 PolarHBondContact O-N 2.9Å; I540-A543 VanDerWaalsContact O-N 3.17Å; A543-K545 VanDerWaalsContact C-N 3.3Å; A543-K545 PolarHBondContact O-N 3.37Å; A543-I546 PolarHBondContact O-N 2.9Å; A543-A547 WeakPolarHBondContact O-CB 3.32Å; A543-A547 PolarHBondContact O-N 3.17Å
544	E	91.3	Very high	87.2	Confident	107 Å²	107	70.9 Å²	70.9	50%	0.5	40%	0.401	S	S	.	.	H	α-helix	trans	-60.8	-38.9	174.9	-72.4	-177.9	-173.4	0	0	112.4	I540 A547 K548	I540-E544 WeakPolarHBondContact O-CG 3.04Å; I540-E544 PolarHBondContact O-N 3.42Å; E544-A547 PolarHBondContact O-N 3.24Å; E544-K548 WeakPolarHBondContact O-CG 3.1Å; E544-K548 PolarHBondContact O-N 3.27Å
545	K	90.2	Very high	87.2	Confident	124 Å²	124	74.7 Å²	74.7	54%	0.539	42%	0.422	S	S	.	.	H	α-helix	trans	-64.2	-47	175.9	-175.5	179.1	171.9	-177.7	0	111.6	A541 K542 A543 A547 K548 E549	A541-K545 PolarHBondContact O-N 2.82Å; A541-K545 VanDerWaalsContact O-N 3.12Å; K542-K545 PolarHBondContact O-N 2.82Å; A543-K545 VanDerWaalsContact C-N 3.3Å; A543-K545 PolarHBondContact O-N 3.37Å; K545-A547 VanDerWaalsContact C-N 3.31Å; K545-A547 PolarHBondContact O-N 3.15Å; K545-K548 PolarHBondContact O-N 2.89Å; K545-E549 WeakPolarHBondContact CE-OE1 3.3Å; K545-E549 IonicContact NZ-OE1 3.21Å; K545-E549 WeakPolarHBondContact O-CG 3.36Å; K545-E549 PolarHBondContact O-N 3.24Å
546	I	87.5	Confident	87	Confident	34 Å²	34	78.8 Å²	78.8	17%	0.174	44%	0.443	C	S	.	.	H	α-helix	trans	-62	-40.2	177.7	-67	165.1	0	0	0	110.9	P526 Q528 K542 A543 E549 S550	P526-I546 HydrophobicContact CG-CD1 4.37Å; Q528-I546 HydrophobicContact CB-CD1 4.25Å; K542-I546 HydrophobicContact CG-CD1 4.21Å; K542-I546 VanDerWaalsContact O-CG1 3.3Å; K542-I546 WeakPolarHBondContact O-CG1 3.43Å; K542-I546 PolarHBondContact O-N 3.28Å; A543-I546 PolarHBondContact O-N 2.9Å; I546-E549 PolarHBondContact O-N 3.48Å; I546-S550 WeakPolarHBondContact O-CB 3.43Å; I546-S550 PolarHBondContact O-N 3.44Å; I546-S550 PolarHBondContact O-OG 3.01Å
547	A	87.2	Confident	86.8	Confident	59 Å²	59	82.6 Å²	82.6	49%	0.488	47%	0.465	S	S	.	.	H	α-helix	trans	-63.5	-40.6	176.8	0	0	0	0	0	112.1	A543 E544 K545 S550 A551	A543-A547 WeakPolarHBondContact O-CB 3.32Å; A543-A547 PolarHBondContact O-N 3.17Å; E544-A547 PolarHBondContact O-N 3.24Å; K545-A547 VanDerWaalsContact C-N 3.31Å; K545-A547 PolarHBondContact O-N 3.15Å; A547-S550 PolarHBondContact O-N 3.28Å; A547-A551 WeakPolarHBondContact O-CB 3.39Å; A547-A551 PolarHBondContact O-N 2.87Å; A547-A551 VanDerWaalsContact O-N 3.12Å
548	K	87.8	Confident	86.6	Confident	143 Å²	143	77.8 Å²	77.8	62%	0.622	45%	0.448	S	S	*	.	H	α-helix	trans	-64.7	-43.6	174.7	-73.7	169.1	-175.9	166	0	112.2	E544 K545 S550 A551 S552	E544-K548 WeakPolarHBondContact O-CG 3.1Å; E544-K548 PolarHBondContact O-N 3.27Å; K545-K548 PolarHBondContact O-N 2.89Å; K548-S550 VanDerWaalsContact C-N 3.33Å; K548-A551 PolarHBondContact O-N 3.17Å; K548-S552 PolarHBondContact O-N 2.9Å; K548-S552 PolarHBondContact O-OG 3.13Å
549	E	83.8	Confident	86.3	Confident	110 Å²	110	78.9 Å²	78.9	51%	0.514	46%	0.459	S	S	.	.	H	α-helix	trans	-69.4	-28.3	178.5	-71.7	173.9	178.6	0	0	113	K545 I546 S552	K545-E549 WeakPolarHBondContact CE-OE1 3.3Å; K545-E549 IonicContact NZ-OE1 3.21Å; K545-E549 WeakPolarHBondContact O-CG 3.36Å; K545-E549 PolarHBondContact O-N 3.24Å; I546-E549 PolarHBondContact O-N 3.48Å; E549-S552 PolarHBondContact O-OG 2.8Å
550	S	80	Confident	85.8	Confident	96 Å²	96	84.9 Å²	84.9	67%	0.671	49%	0.494	S	S	*	.	H	α-helix	trans	-81.5	-21.8	176.1	-54.9	0	0	0	0	112.9	I546 A547 K548	I546-S550 WeakPolarHBondContact O-CB 3.43Å; I546-S550 PolarHBondContact O-N 3.44Å; I546-S550 PolarHBondContact O-OG 3.01Å; A547-S550 PolarHBondContact O-N 3.28Å; K548-S550 VanDerWaalsContact C-N 3.33Å
551	A	77	Confident	85.3	Confident	91 Å²	91	86.9 Å²	86.9	75%	0.752	51%	0.51	S	S	*	.	H	α-helix	trans	-87.4	-21.6	178.2	0	0	0	0	0	113.2	A547 K548	A547-A551 WeakPolarHBondContact O-CB 3.39Å; A547-A551 PolarHBondContact O-N 2.87Å; A547-A551 VanDerWaalsContact O-N 3.12Å; K548-A551 PolarHBondContact O-N 3.17Å
552	S	66	Low	84.8	Confident	146 Å²	146	89.6 Å²	89.6	100%	1.021	51%	0.513	S	S	*	.			trans	-84.5	0	171.3	61.6	0	0	0	0	111.7	K548 E549	K548-S552 PolarHBondContact O-N 2.9Å; K548-S552 PolarHBondContact O-OG 3.13Å; E549-S552 PolarHBondContact O-OG 2.8Å

Retrieved 552 of 552 residues in 300.1 ms (Link to these results)

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